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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H37N3O7S
Molecular Weight 523.642
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CARBAMIC ACID, (3-(((4-AMINOPHENYL)SULFONYL)(2-METHYLPROPYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-, 3-HYDROXY-1-(HYDROXYMETHYL)PROPYL ESTER, (1S-(1R*(R*),2S*))-

SMILES

CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H](CO)CCO)S(=O)(=O)C2=CC=C(N)C=C2

InChI

InChIKey=ABVOUALHESADLP-OEMFJLHTSA-N
InChI=1S/C25H37N3O7S/c1-18(2)15-28(36(33,34)22-10-8-20(26)9-11-22)16-24(31)23(14-19-6-4-3-5-7-19)27-25(32)35-21(17-30)12-13-29/h3-11,18,21,23-24,29-31H,12-17,26H2,1-2H3,(H,27,32)/t21-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H37N3O7S
Molecular Weight 523.642
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:12:02 GMT 2023
Edited
by admin
on Sat Dec 16 16:12:02 GMT 2023
Record UNII
QB48RKO9ZK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBAMIC ACID, (3-(((4-AMINOPHENYL)SULFONYL)(2-METHYLPROPYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-, 3-HYDROXY-1-(HYDROXYMETHYL)PROPYL ESTER, (1S-(1R*(R*),2S*))-
Systematic Name English
Code System Code Type Description
FDA UNII
QB48RKO9ZK
Created by admin on Sat Dec 16 16:12:02 GMT 2023 , Edited by admin on Sat Dec 16 16:12:02 GMT 2023
PRIMARY
PUBCHEM
154731600
Created by admin on Sat Dec 16 16:12:02 GMT 2023 , Edited by admin on Sat Dec 16 16:12:02 GMT 2023
PRIMARY
CAS
180728-03-4
Created by admin on Sat Dec 16 16:12:02 GMT 2023 , Edited by admin on Sat Dec 16 16:12:02 GMT 2023
PRIMARY
Related Record Type Details
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