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Details

Stereochemistry RACEMIC
Molecular Formula C31H37ClN2O8S
Molecular Weight 633.152
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CMI-392

SMILES

COC1=CC(=CC(CNC(=O)N(C)O)=C1OCCSC2=CC=C(Cl)C=C2)[C@H]3CC[C@@H](O3)C4=CC(OC)=C(OC)C(OC)=C4

InChI

InChIKey=LZVBMKDVEPGGFK-JWQCQUIFSA-N
InChI=1S/C31H37ClN2O8S/c1-34(36)31(35)33-18-21-14-19(15-26(37-2)29(21)41-12-13-43-23-8-6-22(32)7-9-23)24-10-11-25(42-24)20-16-27(38-3)30(40-5)28(17-20)39-4/h6-9,14-17,24-25,36H,10-13,18H2,1-5H3,(H,33,35)/t24-,25-/m1/s1

HIDE SMILES / InChI

Molecular Formula C31H37ClN2O8S
Molecular Weight 633.152
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:36:25 GMT 2023
Edited
by admin
on Fri Dec 15 15:36:25 GMT 2023
Record UNII
59G5JG906D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CMI-392
Code English
LDP-392
Code English
UREA, N'-((2-(2-((4-CHLOROPHENYL)THIO)ETHOXY)-3-METHOXY-5-((2R,5R)-TETRAHYDRO-5-(3,4,5-TRIMETHOXYPHENYL)-2-FURANYL)PHENYL)METHYL)-N-HYDROXY-N-METHYL-, REL-
Systematic Name English
UREA, N'-((2-(2-((4-CHLOROPHENYL)THIO)ETHOXY)-3-METHOXY-5-(TETRAHYDRO-5-(3,4,5-TRIMETHOXYPHENYL)-2-FURANYL)PHENYL)METHYL)-N-HYDROXY-N-METHYL-, TRANS-
Systematic Name English
Code System Code Type Description
FDA UNII
59G5JG906D
Created by admin on Fri Dec 15 15:36:25 GMT 2023 , Edited by admin on Fri Dec 15 15:36:25 GMT 2023
PRIMARY
CAS
193739-23-0
Created by admin on Fri Dec 15 15:36:25 GMT 2023 , Edited by admin on Fri Dec 15 15:36:25 GMT 2023
PRIMARY
PUBCHEM
9917282
Created by admin on Fri Dec 15 15:36:25 GMT 2023 , Edited by admin on Fri Dec 15 15:36:25 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY