5-ethanoyl-4-(4-fluorophenyl)-6-methyl-2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-4-(4-fluorophenyl)-6-methyl-2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(4-fluorophenyl)-6-methyl-2-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-fluorophenyl)-6-methyl-2-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(4-fluorophenyl)-6-methyl-2-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(4-fluorophenyl)-2-[[2-keto-2-(2-naphthyl)ethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C27H21FN2O2S MolecularWeight: 456.531243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=CC3=CC=CC=C3C=C2)C#N)C4=CC=C(C=C4)F)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=CC3=CC=CC=C3C=C2)C#N)C4=CC=C(C=C4)F)C(=O)C

InChI

InChI=1S/C27H21FN2O2S/c1-16-25(17(2)31)26(19-9-11-22(28)12-10-19)23(14-29)27(30-16)33-15-24(32)21-8-7-18-5-3-4-6-20(18)13-21/h3-13,26,30H,15H2,1-2H3