5-ethanoyl-6-methyl-4-(3-methylthiophen-2-yl)-2-phenacylsulfanyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-4-(3-methylthiophen-2-yl)-2-phenacylsulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-4-(3-methyl-2-thienyl)-2-phenacylsulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-6-methyl-4-(3-methyl-2-thiophenyl)-2-(phenacylthio)-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-6-methyl-4-(3-methylthiophen-2-yl)-2-phenacylsulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-4-(3-methyl-2-thienyl)-2-(phenacylthio)-1,4-dihydropyridine-3-carbonitrile Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(=C(NC(=C2C(=O)C)C)SCC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(SC=C1)C2C(=C(NC(=C2C(=O)C)C)SCC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H20N2O2S2/c1-13-9-10-27-21(13)20-17(11-23)22(24-14(2)19(20)15(3)25)28-12-18(26)16-7-5-4-6-8-16/h4-10,20,24H,12H2,1-3H3