[2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-benzamidobutanoate

Systemtic Name: [2-[(4-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 4-benzamidobutanoate Openeye Name: [2-(4-methylsulfanylanilino)-2-oxo-ethyl] 4-benzamidobutanoate CAS Name: 4-benzamidobutanoic acid [2-[4-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylanilino)-2-oxoethyl] 4-benzamidobutanoate Traditional Name: 4-benzamidobutyric acid [2-keto-2-[4-(methylthio)anilino]ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)COC(=O)CCCNC(=O)C2=CC=CC=C2

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)COC(=O)CCCNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-27-17-11-9-16(10-12-17)22-18(23)14-26-19(24)8-5-13-21-20(25)15-6-3-2-4-7-15/h2-4,6-7,9-12H,5,8,13-14H2,1H3,(H,21,25)(H,22,23)