2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 2-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-2-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[[2-(3,4-dimethylphenyl)-2-keto-ethyl]thio]-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carbonitrile Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CS3)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CS3)C#N)C

InChI

InChI=1S/C23H22N2O2S2/c1-13-7-8-17(10-14(13)2)19(27)12-29-23-18(11-24)22(20-6-5-9-28-20)21(16(4)26)15(3)25-23/h5-10,22,25H,12H2,1-4H3