N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]ethanamide

Systemtic Name: N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]ethanamide Openeye Name: N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]acetamide CAS Name: N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-quinoxalinyl]acetamide IUPAC Name: N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]quinoxalin-2-yl]acetamide Traditional Name: N-butyl-2-cyano-2-[3-[4-(2,3-dimethylphenyl)piperazino]quinoxalin-2-yl]acetamide Formula: C27H32N6O MolecularWeight: 456.58258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C4=CC=CC(=C4C)C

Isomeric SMILES

CCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C27H32N6O/c1-4-5-13-29-27(34)21(18-28)25-26(31-23-11-7-6-10-22(23)30-25)33-16-14-32(15-17-33)24-12-8-9-19(2)20(24)3/h6-12,21H,4-5,13-17H2,1-3H3,(H,29,34)