2-(3-azanylquinoxalin-2-yl)sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-(3-azanylquinoxalin-2-yl)sulfanyl-1-phenyl-ethanone Openeye Name: 2-(3-aminoquinoxalin-2-yl)sulfanyl-1-phenyl-ethanone CAS Name: 2-[(3-amino-2-quinoxalinyl)thio]-1-phenylethanone IUPAC Name: 2-(3-aminoquinoxalin-2-yl)sulfanyl-1-phenylethanone Traditional Name: 2-[(3-aminoquinoxalin-2-yl)thio]-1-phenyl-ethanone Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N=C2N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N=C2N

InChI

InChI=1S/C16H13N3OS/c17-15-16(19-13-9-5-4-8-12(13)18-15)21-10-14(20)11-6-2-1-3-7-11/h1-9H,10H2,(H2,17,18)