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

Systemtic Name: (4R)-5-cyano-6-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4R)-5-cyano-6-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-2-methyl-N-phenyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide CAS Name: (4R)-5-cyano-6-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-2-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4R)-5-cyano-6-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4R)-5-cyano-6-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-2-methyl-N-phenyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxamide Formula: C26H21FN4O2S2 MolecularWeight: 504.598943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=CS3)C#N)SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2)C3=CC=CS3)C#N)SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C26H21FN4O2S2/c1-16-23(25(33)31-18-6-3-2-4-7-18)24(21-8-5-13-34-21)20(14-28)26(29-16)35-15-22(32)30-19-11-9-17(27)10-12-19/h2-13,23-24H,15H2,1H3,(H,30,32)(H,31,33)/t23?,24-/m1/s1