2-(4-azanyl-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-(4-chlorophenyl)ethanamide

Systemtic Name: 2-(4-azanyl-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-(4-chlorophenyl)ethanamide Openeye Name: 2-(4-amino-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-(4-chlorophenyl)acetamide CAS Name: 2-[(4-amino-3-cyano-2-pyrido[3,2-b]quinoxalinyl)thio]-N-(4-chlorophenyl)acetamide IUPAC Name: 2-(4-amino-3-cyanopyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-(4-chlorophenyl)acetamide Traditional Name: 2-[(4-amino-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)thio]-N-(4-chlorophenyl)acetamide Formula: C20H13ClN6OS MolecularWeight: 420.87482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C(=C(C(=NC3=N2)SCC(=O)NC4=CC=C(C=C4)Cl)C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C(=C(C(=NC3=N2)SCC(=O)NC4=CC=C(C=C4)Cl)C#N)N

InChI

InChI=1S/C20H13ClN6OS/c21-11-5-7-12(8-6-11)24-16(28)10-29-20-13(9-22)17(23)18-19(27-20)26-15-4-2-1-3-14(15)25-18/h1-8H,10H2,(H,24,28)(H2,23,26,27)