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

Systemtic Name: 2-(4-azanyl-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-(4-amino-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: 2-[(4-amino-3-cyano-2-pyrido[3,2-b]quinoxalinyl)thio]-N-phenylacetamide IUPAC Name: 2-(4-amino-3-cyanopyrido[3,2-b]quinoxalin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(4-amino-3-cyano-pyrido[3,2-b]quinoxalin-2-yl)thio]-N-phenyl-acetamide Formula: C20H14N6OS MolecularWeight: 386.42976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=NC3=NC4=CC=CC=C4N=C3C(=C2C#N)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=NC3=NC4=CC=CC=C4N=C3C(=C2C#N)N

InChI

InChI=1S/C20H14N6OS/c21-10-13-17(22)18-19(25-15-9-5-4-8-14(15)24-18)26-20(13)28-11-16(27)23-12-6-2-1-3-7-12/h1-9H,11H2,(H,23,27)(H2,22,25,26)