(4S)-6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-4-(2-furyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide CAS Name: (4S)-6-[(2-amino-2-oxoethyl)thio]-5-cyano-4-(2-furanyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-6-[(2-amino-2-keto-ethyl)thio]-5-cyano-4-(2-furyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O3S/c1-12-17(19(26)24-13-6-3-2-4-7-13)18(15-8-5-9-27-15)14(10-21)20(23-12)28-11-16(22)25/h2-9,17-18H,11H2,1H3,(H2,22,25)(H,24,26)/t17?,18-/m0/s1