(4R)-5-ethanoyl-4-(furan-2-yl)-6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3,4-dihydropyridine-3-carbonitrile

Systemtic Name: (4R)-5-ethanoyl-4-(furan-2-yl)-6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3,4-dihydropyridine-3-carbonitrile Openeye Name: (4R)-5-acetyl-4-(2-furyl)-6-methyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-3,4-dihydropyridine-3-carbonitrile CAS Name: (4R)-5-acetyl-4-(2-furanyl)-6-methyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3,4-dihydropyridine-3-carbonitrile IUPAC Name: (4R)-5-acetyl-4-(furan-2-yl)-6-methyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-3,4-dihydropyridine-3-carbonitrile Traditional Name: (4R)-5-acetyl-4-(2-furyl)-2-[[2-keto-2-(p-tolyl)ethyl]thio]-6-methyl-3,4-dihydropyridine-3-carbonitrile Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C(C(C2C#N)C3=CC=CO3)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C([C@@H](C2C#N)C3=CC=CO3)C(=O)C)C

InChI

InChI=1S/C22H20N2O3S/c1-13-6-8-16(9-7-13)18(26)12-28-22-17(11-23)21(19-5-4-10-27-19)20(15(3)25)14(2)24-22/h4-10,17,21H,12H2,1-3H3/t17?,21-/m0/s1