(4R)-5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanyl-N-phenyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4R)-5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4R)-5-cyano-4-(2-furyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4R)-5-cyano-4-(2-furanyl)-2-methyl-6-(phenacylthio)-N-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4R)-5-cyano-4-(furan-2-yl)-2-methyl-6-phenacylsulfanyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4R)-5-cyano-4-(2-furyl)-2-methyl-6-(phenacylthio)-N-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=CO3)C#N)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)NC2=CC=CC=C2)C3=CC=CO3)C#N)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O3S/c1-17-23(25(31)29-19-11-6-3-7-12-19)24(22-13-8-14-32-22)20(15-27)26(28-17)33-16-21(30)18-9-4-2-5-10-18/h2-14,23-24H,16H2,1H3,(H,29,31)/t23?,24-/m1/s1