4-[4-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]phenyl]-3-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[4-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]phenyl]-3-methyl-1H-1,2,4-triazol-5-one Openeye Name: 4-[4-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]phenyl]-3-methyl-1H-1,2,4-triazol-5-one CAS Name: 4-[4-[4-(5-methoxy-2-pyrimidinyl)-1-piperazinyl]phenyl]-3-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 4-[4-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]phenyl]-3-methyl-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-[4-(5-methoxypyrimidin-2-yl)piperazino]phenyl]-3-methyl-1H-1,2,4-triazol-5-one Formula: C18H21N7O2 MolecularWeight: 367.40504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N1C2=CC=C(C=C2)N3CCN(CC3)C4=NC=C(C=N4)OC

Isomeric SMILES

CC1=NNC(=O)N1C2=CC=C(C=C2)N3CCN(CC3)C4=NC=C(C=N4)OC

InChI

InChI=1S/C18H21N7O2/c1-13-21-22-18(26)25(13)15-5-3-14(4-6-15)23-7-9-24(10-8-23)17-19-11-16(27-2)12-20-17/h3-6,11-12H,7-10H2,1-2H3,(H,22,26)