1-[[4-[(5-azanyl-4,6-dimethyl-pyridin-2-yl)amino]phenyl]methyl]-4-(phenylmethyl)piperazine-2,3-dione

Systemtic Name: 1-[[4-[(5-azanyl-4,6-dimethyl-pyridin-2-yl)amino]phenyl]methyl]-4-(phenylmethyl)piperazine-2,3-dione Openeye Name: 1-[[4-[(5-amino-4,6-dimethyl-2-pyridyl)amino]phenyl]methyl]-4-benzyl-piperazine-2,3-dione CAS Name: 1-[[4-[(5-amino-4,6-dimethyl-2-pyridinyl)amino]phenyl]methyl]-4-(phenylmethyl)piperazine-2,3-dione IUPAC Name: 1-[[4-[(5-amino-4,6-dimethylpyridin-2-yl)amino]phenyl]methyl]-4-benzylpiperazine-2,3-dione Traditional Name: 1-[4-[(5-amino-4,6-dimethyl-2-pyridyl)amino]benzyl]-4-benzyl-piperazine-2,3-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1N)C)NC2=CC=C(C=C2)CN3CCN(C(=O)C3=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=C1N)C)NC2=CC=C(C=C2)CN3CCN(C(=O)C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2/c1-17-14-22(27-18(2)23(17)26)28-21-10-8-20(9-11-21)16-30-13-12-29(24(31)25(30)32)15-19-6-4-3-5-7-19/h3-11,14H,12-13,15-16,26H2,1-2H3,(H,27,28)