(2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-oxidanylidene-5-[(4-phenylsulfanylphenyl)amino]pentanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 5-oxidanylidene-5-[(4-phenylsulfanylphenyl)amino]pentanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 5-oxo-5-(4-phenylsulfanylanilino)pentanoate CAS Name: 5-oxo-5-[4-(phenylthio)anilino]pentanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 5-oxo-5-(4-phenylsulfanylanilino)pentanoate Traditional Name: 5-keto-5-[4-(phenylthio)anilino]valeric acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C23H21NO4S2 MolecularWeight: 439.54714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC=CS3

InChI

InChI=1S/C23H21NO4S2/c25-20(21-8-5-15-29-21)16-28-23(27)10-4-9-22(26)24-17-11-13-19(14-12-17)30-18-6-2-1-3-7-18/h1-3,5-8,11-15H,4,9-10,16H2,(H,24,26)