2-cyano-N-[3-[(phenylmethyl)amino]quinoxalin-2-yl]ethanamide

Systemtic Name: 2-cyano-N-[3-[(phenylmethyl)amino]quinoxalin-2-yl]ethanamide Openeye Name: N-[3-(benzylamino)quinoxalin-2-yl]-2-cyano-acetamide CAS Name: 2-cyano-N-[3-[(phenylmethyl)amino]-2-quinoxalinyl]acetamide IUPAC Name: N-[3-(benzylamino)quinoxalin-2-yl]-2-cyanoacetamide Traditional Name: N-[3-(benzylamino)quinoxalin-2-yl]-2-cyano-acetamide Formula: C18H15N5O MolecularWeight: 317.3446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N=C2NC(=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N=C2NC(=O)CC#N

InChI

InChI=1S/C18H15N5O/c19-11-10-16(24)23-18-17(20-12-13-6-2-1-3-7-13)21-14-8-4-5-9-15(14)22-18/h1-9H,10,12H2,(H,20,21)(H,22,23,24)