ethyl (3S,4S)-3-cyano-6-methyl-2-sulfanylidene-4-thiophen-3-yl-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: ethyl (3S,4S)-3-cyano-6-methyl-2-sulfanylidene-4-thiophen-3-yl-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: ethyl (3S,4S)-3-cyano-6-methyl-4-(3-thienyl)-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (3S,4S)-3-cyano-6-methyl-2-sulfanylidene-4-(3-thiophenyl)-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4S)-3-cyano-6-methyl-2-sulfanylidene-4-thiophen-3-yl-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (3S,4S)-3-cyano-6-methyl-4-(3-thienyl)-2-thioxo-3,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester Formula: C14H14N2O2S2 MolecularWeight: 306.40316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)C(C1C2=CSC=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)[C@@H]([C@@H]1C2=CSC=C2)C#N)C

InChI

InChI=1S/C14H14N2O2S2/c1-3-18-14(17)11-8(2)16-13(19)10(6-15)12(11)9-4-5-20-7-9/h4-5,7,10,12H,3H2,1-2H3,(H,16,19)/t10-,12+/m1/s1