2-[[(4S)-2-azanyl-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[(4S)-2-azanyl-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]sulfanyl]ethanamide Openeye Name: 2-[[(4S)-2-amino-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]sulfanyl]acetamide CAS Name: 2-[[(4S)-2-amino-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]thio]acetamide IUPAC Name: 2-[[(4S)-2-amino-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]sulfanyl]acetamide Traditional Name: 2-[[(4S)-2-amino-4-(2-chlorophenyl)-3,5-dicyano-3,4-dihydropyridin-6-yl]thio]acetamide Formula: C15H12ClN5OS MolecularWeight: 345.80668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN5OS/c16-11-4-2-1-3-8(11)13-9(5-17)14(20)21-15(10(13)6-18)23-7-12(19)22/h1-4,9,13H,7H2,(H2,19,22)(H2,20,21)/t9?,13-/m0/s1