(4S)-5-cyano-6-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-5-cyano-6-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-5-cyano-6-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]sulfanyl-2-methyl-N-(o-tolyl)-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-5-cyano-6-[[2-(4-cyclohexylphenyl)-2-oxoethyl]thio]-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-5-cyano-6-[2-(4-cyclohexylphenyl)-2-oxoethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-5-cyano-6-[[2-(4-cyclohexylphenyl)-2-keto-ethyl]thio]-2-methyl-N-(o-tolyl)-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide Formula: C33H33N3O2S2 MolecularWeight: 567.76402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2C(C(=C(N=C2C)SCC(=O)C3=CC=C(C=C3)C4CCCCC4)C#N)C5=CC=CS5

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2[C@@H](C(=C(N=C2C)SCC(=O)C3=CC=C(C=C3)C4CCCCC4)C#N)C5=CC=CS5

InChI

InChI=1S/C33H33N3O2S2/c1-21-9-6-7-12-27(21)36-32(38)30-22(2)35-33(26(19-34)31(30)29-13-8-18-39-29)40-20-28(37)25-16-14-24(15-17-25)23-10-4-3-5-11-23/h6-9,12-18,23,30-31H,3-5,10-11,20H2,1-2H3,(H,36,38)/t30?,31-/m0/s1