5-cyano-6-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-6-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-6-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-(cyanomethylthio)-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-6-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-(cyanomethylthio)-N-(2-methoxyphenyl)-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC#N)C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC#N)C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H18N4O2S2/c1-13-18(20(26)25-15-6-3-4-7-16(15)27-2)19(17-8-5-10-28-17)14(12-23)21(24-13)29-11-9-22/h3-8,10,19,24H,11H2,1-2H3,(H,25,26)