[2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(naphthalen-2-ylcarbonylamino)ethanoate

Systemtic Name: [2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(naphthalen-2-ylcarbonylamino)ethanoate Openeye Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxo-ethyl] 2-(naphthalene-2-carbonylamino)acetate CAS Name: 2-[[2-naphthalenyl(oxo)methyl]amino]acetic acid [2-[2-(cyanomethylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxoethyl] 2-(naphthalene-2-carbonylamino)acetate Traditional Name: 2-(2-naphthoylamino)acetic acid [2-[2-(cyanomethylthio)anilino]-2-keto-ethyl] ester Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)NCC(=O)OCC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)NCC(=O)OCC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C23H19N3O4S/c24-11-12-31-20-8-4-3-7-19(20)26-21(27)15-30-22(28)14-25-23(29)18-10-9-16-5-1-2-6-17(16)13-18/h1-10,13H,12,14-15H2,(H,25,29)(H,26,27)