2-[4-azanyl-2-[(4-sulfamoylphenyl)amino]-1,3-thiazol-5-yl]-5-(phenylmethyl)-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[4-azanyl-2-[(4-sulfamoylphenyl)amino]-1,3-thiazol-5-yl]-5-(phenylmethyl)-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[4-amino-2-(4-sulfamoylanilino)thiazol-5-yl]-5-benzyl-thiazole-4-carboxylic acid CAS Name: 2-[4-amino-2-(4-sulfamoylanilino)-5-thiazolyl]-5-(phenylmethyl)-4-thiazolecarboxylic acid IUPAC Name: 2-[4-amino-2-(4-sulfamoylanilino)-1,3-thiazol-5-yl]-5-benzyl-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[4-amino-2-(4-sulfamoylanilino)thiazol-5-yl]-5-benzyl-thiazole-4-carboxylic acid Formula: C20H17N5O4S3 MolecularWeight: 487.57508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C(S2)C3=C(N=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C(S2)C3=C(N=C(S3)NC4=CC=C(C=C4)S(=O)(=O)N)N)C(=O)O

InChI

InChI=1S/C20H17N5O4S3/c21-17-16(31-20(25-17)23-12-6-8-13(9-7-12)32(22,28)29)18-24-15(19(26)27)14(30-18)10-11-4-2-1-3-5-11/h1-9H,10,21H2,(H,23,25)(H,26,27)(H2,22,28,29)