[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl] 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: [2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl] 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: [2-(2-naphthylamino)-2-oxo-ethyl] 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid [2-(2-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-2-ylamino)-2-oxoethyl] 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid [2-keto-2-(2-naphthylamino)ethyl] ester Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)OCC(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24N2O4S/c1-31-14-13-21(26-23(28)18-8-3-2-4-9-18)24(29)30-16-22(27)25-20-12-11-17-7-5-6-10-19(17)15-20/h2-12,15,21H,13-14,16H2,1H3,(H,25,27)(H,26,28)