6-[[3-[2-(diphenylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[3-[2-(diphenylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[3-[2-oxo-2-(N-phenylanilino)ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[oxo-[3-[[2-oxo-2-(N-phenylanilino)ethyl]thio]anilino]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[3-[2-oxo-2-(N-phenylanilino)ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-[[2-keto-2-(N-phenylanilino)ethyl]thio]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C28H26N2O4S MolecularWeight: 486.58204

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC(=CC=C2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=CC(=CC=C2)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H26N2O4S/c31-26(30(21-11-3-1-4-12-21)22-13-5-2-6-14-22)19-35-23-15-9-10-20(18-23)29-27(32)24-16-7-8-17-25(24)28(33)34/h1-15,18,24-25H,16-17,19H2,(H,29,32)(H,33,34)