5-[4-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]butoxy]-2-methyl-1,2,4-triazin-3-one

Systemtic Name: 5-[4-[4-(5-fluoranylpyrimidin-2-yl)piperazin-1-yl]butoxy]-2-methyl-1,2,4-triazin-3-one Openeye Name: 5-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butoxy]-2-methyl-1,2,4-triazin-3-one CAS Name: 5-[4-[4-(5-fluoro-2-pyrimidinyl)-1-piperazinyl]butoxy]-2-methyl-1,2,4-triazin-3-one IUPAC Name: 5-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butoxy]-2-methyl-1,2,4-triazin-3-one Traditional Name: 5-[4-[4-(5-fluoropyrimidin-2-yl)piperazino]butoxy]-2-methyl-1,2,4-triazin-3-one Formula: C16H22FN7O2 MolecularWeight: 363.389983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N=C(C=N1)OCCCCN2CCN(CC2)C3=NC=C(C=N3)F

Isomeric SMILES

CN1C(=O)N=C(C=N1)OCCCCN2CCN(CC2)C3=NC=C(C=N3)F

InChI

InChI=1S/C16H22FN7O2/c1-22-16(25)21-14(12-20-22)26-9-3-2-4-23-5-7-24(8-6-23)15-18-10-13(17)11-19-15/h10-12H,2-9H2,1H3