4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-yl]-3-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-yl]-3-methyl-1H-1,2,4-triazol-5-one Openeye Name: 4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-3-pyridyl]-3-methyl-1H-1,2,4-triazol-5-one CAS Name: 4-[6-[4-(4-methoxyphenyl)-1-piperazinyl]-3-pyridinyl]-3-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-3-yl]-3-methyl-1H-1,2,4-triazol-5-one Traditional Name: 4-[6-[4-(4-methoxyphenyl)piperazino]-3-pyridyl]-3-methyl-1H-1,2,4-triazol-5-one Formula: C19H22N6O2 MolecularWeight: 366.41698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N6O2/c1-14-21-22-19(26)25(14)16-5-8-18(20-13-16)24-11-9-23(10-12-24)15-3-6-17(27-2)7-4-15/h3-8,13H,9-12H2,1-2H3,(H,22,26)