(4R)-2-azanyl-4-(3-chlorophenyl)-3-cyano-6-sulfanyl-3,4-dihydropyridine-5-carboxamide

Systemtic Name: (4R)-2-azanyl-4-(3-chlorophenyl)-3-cyano-6-sulfanyl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4R)-2-amino-4-(3-chlorophenyl)-3-cyano-6-sulfanyl-3,4-dihydropyridine-5-carboxamide CAS Name: (4R)-2-amino-4-(3-chlorophenyl)-3-cyano-6-mercapto-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4R)-2-amino-4-(3-chlorophenyl)-3-cyano-6-sulfanyl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4R)-2-amino-4-(3-chlorophenyl)-3-cyano-6-mercapto-3,4-dihydropyridine-5-carboxamide Formula: C13H11ClN4OS MolecularWeight: 306.77064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2C(C(=NC(=C2C(=O)N)S)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)[C@H]2C(C(=NC(=C2C(=O)N)S)N)C#N

InChI

InChI=1S/C13H11ClN4OS/c14-7-3-1-2-6(4-7)9-8(5-15)11(16)18-13(20)10(9)12(17)19/h1-4,8-9,20H,(H2,16,18)(H2,17,19)/t8?,9-/m0/s1