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

Systemtic Name: (4S)-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-3-cyano-4,6-dimethyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4S)-2-(2-amino-2-oxo-ethyl)sulfanyl-3-cyano-4,6-dimethyl-N-phenyl-3,4-dihydropyridine-5-carboxamide CAS Name: (4S)-2-[(2-amino-2-oxoethyl)thio]-3-cyano-4,6-dimethyl-N-phenyl-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4S)-2-(2-amino-2-oxoethyl)sulfanyl-3-cyano-4,6-dimethyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4S)-2-[(2-amino-2-keto-ethyl)thio]-3-cyano-4,6-dimethyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=NC(=C1C(=O)NC2=CC=CC=C2)C)SCC(=O)N)C#N

Isomeric SMILES

C[C@H]1C(C(=NC(=C1C(=O)NC2=CC=CC=C2)C)SCC(=O)N)C#N

InChI

InChI=1S/C17H18N4O2S/c1-10-13(8-18)17(24-9-14(19)22)20-11(2)15(10)16(23)21-12-6-4-3-5-7-12/h3-7,10,13H,9H2,1-2H3,(H2,19,22)(H,21,23)/t10-,13?/m0/s1