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

Systemtic Name: (4S)-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4S)-2-(2-amino-2-oxo-ethyl)sulfanyl-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide CAS Name: (4S)-2-[(2-amino-2-oxoethyl)thio]-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4S)-2-(2-amino-2-oxoethyl)sulfanyl-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4S)-2-[(2-amino-2-keto-ethyl)thio]-3-cyano-6-methyl-4-o-phenetyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)N)C#N

Isomeric SMILES

CCOC1=CC=CC=C1[C@@H]2C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)N)C#N

InChI

InChI=1S/C24H24N4O3S/c1-3-31-19-12-8-7-11-17(19)22-18(13-25)24(32-14-20(26)29)27-15(2)21(22)23(30)28-16-9-5-4-6-10-16/h4-12,18,22H,3,14H2,1-2H3,(H2,26,29)(H,28,30)/t18?,22-/m1/s1