2-methyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-1,2,4-triazin-3-one

Systemtic Name: 2-methyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-1,2,4-triazin-3-one Openeye Name: 2-methyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-1,2,4-triazin-3-one CAS Name: 2-methyl-5-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butylamino]-1,2,4-triazin-3-one IUPAC Name: 2-methyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-1,2,4-triazin-3-one Traditional Name: 2-methyl-5-[4-[4-(2-pyrimidyl)piperazino]butylamino]-1,2,4-triazin-3-one Formula: C16H24N8O MolecularWeight: 344.41476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N=C(C=N1)NCCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CN1C(=O)N=C(C=N1)NCCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H24N8O/c1-22-16(25)21-14(13-20-22)17-5-2-3-8-23-9-11-24(12-10-23)15-18-6-4-7-19-15/h4,6-7,13H,2-3,5,8-12H2,1H3,(H,17,21,25)