8-[[3-[2-oxidanylidene-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[3-[2-oxidanylidene-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[3-[2-oxo-1-phenyl-2-(thiazol-2-ylamino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[oxo-[3-[[2-oxo-1-phenyl-2-(2-thiazolylamino)ethyl]thio]anilino]methyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[3-[2-oxo-1-phenyl-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-[[2-keto-1-phenyl-2-(thiazol-2-ylamino)ethyl]thio]phenyl]carbamoyl]-1-naphthoic acid Formula: C29H21N3O4S2 MolecularWeight: 539.62474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=NC=CS2)SC3=CC=CC(=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=NC=CS2)SC3=CC=CC(=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

InChI

InChI=1S/C29H21N3O4S2/c33-26(22-13-4-9-18-10-5-14-23(24(18)22)28(35)36)31-20-11-6-12-21(17-20)38-25(19-7-2-1-3-8-19)27(34)32-29-30-15-16-37-29/h1-17,25H,(H,31,33)(H,35,36)(H,30,32,34)