5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-6-[2-(2-ethylanilino)-2-oxo-ethyl]sulfanyl-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-[[2-(2-ethylanilino)-2-oxoethyl]thio]-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-6-[2-(2-ethylanilino)-2-oxoethyl]sulfanyl-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-(2-ethylanilino)-2-keto-ethyl]thio]-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C30H27FN4O2S MolecularWeight: 526.624383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4F)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4F)C#N

InChI

InChI=1S/C30H27FN4O2S/c1-3-20-11-7-10-16-25(20)35-26(36)18-38-30-23(17-32)28(22-14-8-9-15-24(22)31)27(19(2)33-30)29(37)34-21-12-5-4-6-13-21/h4-16,28,33H,3,18H2,1-2H3,(H,34,37)(H,35,36)