5-cyano-6-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-6-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-6-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-6-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C31H30N4O4S2 MolecularWeight: 586.7243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)C#N)C4=CC=CS4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)C#N)C4=CC=CS4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C31H30N4O4S2/c1-19-28(30(37)34-22-8-5-4-6-9-22)29(26-10-7-13-40-26)23(16-32)31(33-19)41-18-27(36)35-12-11-20-14-24(38-2)25(39-3)15-21(20)17-35/h4-10,13-15,29,33H,11-12,17-18H2,1-3H3,(H,34,37)