8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]pyridin-2-yl]quinoxaline-5-carboxamide

Systemtic Name: 8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]pyridin-2-yl]quinoxaline-5-carboxamide Openeye Name: 8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridyl]quinoxaline-5-carboxamide CAS Name: 8-(2,6-dimethylphenyl)-N-[5-[(4-methyl-1-piperazinyl)methyl]-2-pyridinyl]-5-quinoxalinecarboxamide IUPAC Name: 8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]pyridin-2-yl]quinoxaline-5-carboxamide Traditional Name: 8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazino)methyl]-2-pyridyl]quinoxaline-5-carboxamide Formula: C28H30N6O MolecularWeight: 466.5774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=C3C(=C(C=C2)C(=O)NC4=NC=C(C=C4)CN5CCN(CC5)C)N=CC=N3

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=C3C(=C(C=C2)C(=O)NC4=NC=C(C=C4)CN5CCN(CC5)C)N=CC=N3

InChI

InChI=1S/C28H30N6O/c1-19-5-4-6-20(2)25(19)22-8-9-23(27-26(22)29-11-12-30-27)28(35)32-24-10-7-21(17-31-24)18-34-15-13-33(3)14-16-34/h4-12,17H,13-16,18H2,1-3H3,(H,31,32,35)