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

Systemtic Name: 2-[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-4-(furan-2-yl)-6-methyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[2-(2,4-dichlorophenyl)-2-oxo-ethyl]sulfanyl-4-(2-furyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-2-[[2-(2,4-dichlorophenyl)-2-oxoethyl]thio]-4-(2-furanyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-2-[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-6-methyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[[2-(2,4-dichlorophenyl)-2-keto-ethyl]thio]-4-(2-furyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C21H16Cl2N2O3S MolecularWeight: 447.33434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=C(C=C(C=C2)Cl)Cl)C#N)C3=CC=CO3)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=C(C=C(C=C2)Cl)Cl)C#N)C3=CC=CO3)C(=O)C

InChI

InChI=1S/C21H16Cl2N2O3S/c1-11-19(12(2)26)20(18-4-3-7-28-18)15(9-24)21(25-11)29-10-17(27)14-6-5-13(22)8-16(14)23/h3-8,20,25H,10H2,1-2H3