dimethyl (E)-4-(2-methylsulfanylethyl)-4-(C-phenylcarbonimidoyl)pent-2-enedioate

Systemtic Name: dimethyl (E)-4-(2-methylsulfanylethyl)-4-(C-phenylcarbonimidoyl)pent-2-enedioate Openeye Name: dimethyl (E)-4-(benzenecarboximidoyl)-4-(2-methylsulfanylethyl)pent-2-enedioate CAS Name: (E)-4-[imino(phenyl)methyl]-4-[2-(methylthio)ethyl]-2-pentenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-4-(benzenecarboximidoyl)-4-(2-methylsulfanylethyl)pent-2-enedioate Traditional Name: (E)-4-benzimidoyl-4-[2-(methylthio)ethyl]pent-2-enedioic acid dimethyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(CCSC)(C(=N)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)/C=C/C(CCSC)(C(=N)C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H21NO4S/c1-21-14(19)9-10-17(11-12-23-3,16(20)22-2)15(18)13-7-5-4-6-8-13/h4-10,18H,11-12H2,1-3H3/b10-9+,18-15?