8-[[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[3-[1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[3-[[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]thio]anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[3-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-[[2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]thio]phenyl]carbamoyl]-1-naphthoic acid Formula: C27H23N3O6S2 MolecularWeight: 549.61802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

InChI

InChI=1S/C27H23N3O6S2/c1-16(25(31)29-18-11-13-21(14-12-18)38(28,35)36)37-20-8-4-7-19(15-20)30-26(32)22-9-2-5-17-6-3-10-23(24(17)22)27(33)34/h2-16H,1H3,(H,29,31)(H,30,32)(H,33,34)(H2,28,35,36)