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

Systemtic Name: 2-propyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]-1,2,4-triazin-3-one Openeye Name: 2-propyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]-1,2,4-triazin-3-one CAS Name: 2-propyl-5-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butoxy]-1,2,4-triazin-3-one IUPAC Name: 2-propyl-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]-1,2,4-triazin-3-one Traditional Name: 2-propyl-5-[4-[4-(2-pyrimidyl)piperazino]butoxy]-1,2,4-triazin-3-one Formula: C18H27N7O2 MolecularWeight: 373.45268

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N=C(C=N1)OCCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCCN1C(=O)N=C(C=N1)OCCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H27N7O2/c1-2-8-25-18(26)22-16(15-21-25)27-14-4-3-9-23-10-12-24(13-11-23)17-19-6-5-7-20-17/h5-7,15H,2-4,8-14H2,1H3