(4R)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4R)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4R)-6-allylsulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide CAS Name: (4R)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-(prop-2-enylthio)-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4R)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4R)-6-(allylthio)-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2OC)C3=CC=CS3)C#N)SCC=C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2OC)C3=CC=CS3)C#N)SCC=C

InChI

InChI=1S/C22H21N3O2S2/c1-4-11-29-22-15(13-23)20(18-10-7-12-28-18)19(14(2)24-22)21(26)25-16-8-5-6-9-17(16)27-3/h4-10,12,19-20H,1,11H2,2-3H3,(H,25,26)/t19?,20-/m1/s1