8-[[3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[3-[2-oxo-2-(2-thienyl)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[3-[(2-oxo-2-thiophen-2-ylethyl)thio]anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[3-(2-oxo-2-thiophen-2-ylethyl)sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-[[2-keto-2-(2-thienyl)ethyl]thio]phenyl]carbamoyl]-1-naphthoic acid Formula: C24H17NO4S2 MolecularWeight: 447.52608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)NC3=CC(=CC=C3)SCC(=O)C4=CC=CS4)C(=CC=C2)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)NC3=CC(=CC=C3)SCC(=O)C4=CC=CS4)C(=CC=C2)C(=O)O

InChI

InChI=1S/C24H17NO4S2/c26-20(21-11-4-12-30-21)14-31-17-8-3-7-16(13-17)25-23(27)18-9-1-5-15-6-2-10-19(22(15)18)24(28)29/h1-13H,14H2,(H,25,27)(H,28,29)