8-[[4-[2-oxidanylidene-1-phenyl-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[4-[2-oxidanylidene-1-phenyl-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[4-[2-(4-isopropylanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[4-[[2-oxo-1-phenyl-2-(4-propan-2-ylanilino)ethyl]thio]anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[4-[2-oxo-1-phenyl-2-(4-propan-2-ylanilino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[4-[(2-cumidino-2-keto-1-phenyl-ethyl)thio]phenyl]carbamoyl]-1-naphthoic acid Formula: C35H30N2O4S MolecularWeight: 574.6887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

InChI

InChI=1S/C35H30N2O4S/c1-22(2)23-14-16-26(17-15-23)37-34(39)32(25-8-4-3-5-9-25)42-28-20-18-27(19-21-28)36-33(38)29-12-6-10-24-11-7-13-30(31(24)29)35(40)41/h3-22,32H,1-2H3,(H,36,38)(H,37,39)(H,40,41)