diethyl (Z)-3-azanyl-2-cyano-4-(phenylcarbamothioyl)pent-2-enedioate

Systemtic Name: diethyl (Z)-3-azanyl-2-cyano-4-(phenylcarbamothioyl)pent-2-enedioate Openeye Name: diethyl (Z)-3-amino-2-cyano-4-(phenylcarbamothioyl)pent-2-enedioate CAS Name: (Z)-3-amino-4-[anilino(sulfanylidene)methyl]-2-cyano-2-pentenedioic acid diethyl ester IUPAC Name: diethyl (Z)-3-amino-2-cyano-4-(phenylcarbamothioyl)pent-2-enedioate Traditional Name: (Z)-3-amino-2-cyano-4-(phenylthiocarbamoyl)pent-2-enedioic acid diethyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=C(C#N)C(=O)OCC)N)C(=S)NC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(/C(=C(\C#N)/C(=O)OCC)/N)C(=S)NC1=CC=CC=C1

InChI

InChI=1S/C17H19N3O4S/c1-3-23-16(21)12(10-18)14(19)13(17(22)24-4-2)15(25)20-11-8-6-5-7-9-11/h5-9,13H,3-4,19H2,1-2H3,(H,20,25)/b14-12-