8-[[4-(phenylmethylsulfanyl)phenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[4-(phenylmethylsulfanyl)phenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[(4-benzylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[4-(phenylmethylthio)anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[(4-benzylsulfanylphenyl)carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[4-(benzylthio)phenyl]carbamoyl]-1-naphthoic acid Formula: C25H19NO3S MolecularWeight: 413.48826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3C(=CC=C4)C(=O)O

InChI

InChI=1S/C25H19NO3S/c27-24(21-10-4-8-18-9-5-11-22(23(18)21)25(28)29)26-19-12-14-20(15-13-19)30-16-17-6-2-1-3-7-17/h1-15H,16H2,(H,26,27)(H,28,29)