(4R)-2-[2-(4-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide

Systemtic Name: (4R)-2-[2-(4-butylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4R)-2-[2-(4-butylphenyl)-2-oxo-ethyl]sulfanyl-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxamide CAS Name: (4R)-2-[[2-(4-butylphenyl)-2-oxoethyl]thio]-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4R)-2-[2-(4-butylphenyl)-2-oxoethyl]sulfanyl-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4R)-2-[[2-(4-butylphenyl)-2-keto-ethyl]thio]-3-cyano-N-(2-methoxyphenyl)-6-methyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxamide Formula: C31H31N3O3S2 MolecularWeight: 557.72614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CSC2=NC(=C(C(C2C#N)C3=CC=CS3)C(=O)NC4=CC=CC=C4OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CSC2=NC(=C([C@@H](C2C#N)C3=CC=CS3)C(=O)NC4=CC=CC=C4OC)C

InChI

InChI=1S/C31H31N3O3S2/c1-4-5-9-21-13-15-22(16-14-21)25(35)19-39-31-23(18-32)29(27-12-8-17-38-27)28(20(2)33-31)30(36)34-24-10-6-7-11-26(24)37-3/h6-8,10-17,23,29H,4-5,9,19H2,1-3H3,(H,34,36)/t23?,29-/m0/s1