5-ethanoyl-4-(furan-2-yl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-4-(furan-2-yl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-furyl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-furanyl)-6-methyl-2-(3-methylbut-2-enylthio)-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(furan-2-yl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(2-furyl)-6-methyl-2-(3-methylbut-2-enylthio)-1,4-dihydropyridine-3-carbonitrile Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC=C(C)C)C#N)C2=CC=CO2)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC=C(C)C)C#N)C2=CC=CO2)C(=O)C

InChI

InChI=1S/C18H20N2O2S/c1-11(2)7-9-23-18-14(10-19)17(15-6-5-8-22-15)16(13(4)21)12(3)20-18/h5-8,17,20H,9H2,1-4H3