[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C18H16ClN3O4S2 MolecularWeight: 437.92034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C18H16ClN3O4S2/c1-11-2-5-13(6-3-11)21-18-22-14(10-27-18)9-26-17(23)12-4-7-15(19)16(8-12)28(20,24)25/h2-8,10H,9H2,1H3,(H,21,22)(H2,20,24,25)