4-methyl-2-(2-piperazin-1-yl-4-pyrimidin-4-yl-butyl)-1,2,4-triazine-3,5-dione

Systemtic Name: 4-methyl-2-(2-piperazin-1-yl-4-pyrimidin-4-yl-butyl)-1,2,4-triazine-3,5-dione Openeye Name: 4-methyl-2-(2-piperazin-1-yl-4-pyrimidin-4-yl-butyl)-1,2,4-triazine-3,5-dione CAS Name: 4-methyl-2-[2-(1-piperazinyl)-4-(4-pyrimidinyl)butyl]-1,2,4-triazine-3,5-dione IUPAC Name: 4-methyl-2-(2-piperazin-1-yl-4-pyrimidin-4-ylbutyl)-1,2,4-triazine-3,5-dione Traditional Name: 4-methyl-2-[2-piperazino-4-(4-pyrimidyl)butyl]-1,2,4-triazine-3,5-quinone Formula: C16H23N7O2 MolecularWeight: 345.39952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=NN(C1=O)CC(CCC2=NC=NC=C2)N3CCNCC3

Isomeric SMILES

CN1C(=O)C=NN(C1=O)CC(CCC2=NC=NC=C2)N3CCNCC3

InChI

InChI=1S/C16H23N7O2/c1-21-15(24)10-20-23(16(21)25)11-14(22-8-6-17-7-9-22)3-2-13-4-5-18-12-19-13/h4-5,10,12,14,17H,2-3,6-9,11H2,1H3