methyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-2-methyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[(2-amino-2-oxoethyl)thio]-5-cyano-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[(2-amino-2-keto-ethyl)thio]-5-cyano-2-methyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C)SCC(=O)N)C#N

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C)SCC(=O)N)C#N

InChI

InChI=1S/C18H19N3O3S/c1-10-6-4-5-7-12(10)16-13(8-19)17(25-9-14(20)22)21-11(2)15(16)18(23)24-3/h4-7,16,21H,9H2,1-3H3,(H2,20,22)