U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C37H49N3O5S
Molecular Weight 647.867
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IPROTIAZEM

SMILES

COC1=CC(CCN2CCN(CCCCOC3=CC=CC=C3[C@]4(SC5=CC=CC=C5N(C)C4=O)C(C)C)CC2)=CC(OC)=C1OC

InChI

InChIKey=JSLZUBLGGPEVQN-DIPNUNPCSA-N
InChI=1S/C37H49N3O5S/c1-27(2)37(36(41)38(3)30-14-8-10-16-34(30)46-37)29-13-7-9-15-31(29)45-24-12-11-18-39-20-22-40(23-21-39)19-17-28-25-32(42-4)35(44-6)33(26-28)43-5/h7-10,13-16,25-27H,11-12,17-24H2,1-6H3/t37-/m1/s1

HIDE SMILES / InChI

Molecular Formula C37H49N3O5S
Molecular Weight 647.867
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

IPROTIAZEM is a vasodilator.

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:52:28 GMT 2023
Edited
by admin
on Sat Dec 16 15:52:28 GMT 2023
Record UNII
3VPX99Q2D7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IPROTIAZEM
INN  
INN  
Official Name English
iprotiazem [INN]
Common Name English
(+)-(R)-2-ISOPROPYL-4-METHYL-2-(O-(4-(4-(3,4,5-TRIMETHOXYPHENETHYL)-1-PIPERAZINYL)BUTOXY)PHENYL)-2H-1,4-BENZOTHIAZIN-3(4H)-ONE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C333
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
Code System Code Type Description
EVMPD
SUB08286MIG
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID20883155
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
SMS_ID
100000083146
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
ChEMBL
CHEMBL2105875
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
FDA UNII
3VPX99Q2D7
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
PUBCHEM
195131
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
INN
6017
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
NCI_THESAURUS
C81678
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
CAS
105118-13-6
Created by admin on Sat Dec 16 15:52:28 GMT 2023 , Edited by admin on Sat Dec 16 15:52:28 GMT 2023
PRIMARY
Related Record Type Details
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