4?-(Acetylamino)-4-[(3-aminobenzoyl)amino][1,1?-biphenyl]-3-sulfonic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H19N3O5S
Molecular Weight	425.458
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4?-(Acetylamino)-4-[(3-aminobenzoyl)amino][1,1?-biphenyl]-3-sulfonic acid

Structure Search

SMILES

CC(=O)NC1=CC=C(C=C1)C2=CC(=C(NC(=O)C3=CC(N)=CC=C3)C=C2)S(O)(=O)=O

InChI

InChIKey=PPGMTXJUPIBUQX-UHFFFAOYSA-N

InChI=1S/C21H19N3O5S/c1-13(25)23-18-8-5-14(6-9-18)15-7-10-19(20(12-15)30(27,28)29)24-21(26)16-3-2-4-17(22)11-16/h2-12H,22H2,1H3,(H,23,25)(H,24,26)(H,27,28,29)

HIDE SMILES / InChI

Molecular Formula	C21H19N3O5S
Molecular Weight	425.458
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 17:39:18 GMT 2025` Edited by `admin` on `Tue Apr 01 17:39:18 GMT 2025`
Record UNII	9WZ9VLW9SQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4?-(Acetylamino)-4-[(3-aminobenzoyl)amino][1,1?-biphenyl]-3-sulfonic acid

Systematic Name

English

[1,1?-Biphenyl]-3-sulfonic acid, 4?-(acetylamino)-4-[(3-aminobenzoyl)amino]-

Preferred Name

English

Code System Code Type Description

CAS

68189-37-7