4-[[5-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]carbonyl]-1-methyl-piperazin-2-one

Systemtic Name: 4-[[5-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]carbonyl]-1-methyl-piperazin-2-one Openeye Name: 4-[5-(6-methoxy-3-pyridyl)-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]-1-methyl-piperazin-2-one CAS Name: 4-[[5-(6-methoxy-3-pyridinyl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]-oxomethyl]-1-methyl-2-piperazinone IUPAC Name: 4-[5-(6-methoxypyridin-3-yl)-1-(4-methylphenyl)-1,2,4-triazole-3-carbonyl]-1-methylpiperazin-2-one Traditional Name: 4-[5-(6-methoxy-3-pyridyl)-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]-1-methyl-piperazin-2-one Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)N3CCN(C(=O)C3)C)C4=CN=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)N3CCN(C(=O)C3)C)C4=CN=C(C=C4)OC

InChI

InChI=1S/C21H22N6O3/c1-14-4-7-16(8-5-14)27-20(15-6-9-17(30-3)22-12-15)23-19(24-27)21(29)26-11-10-25(2)18(28)13-26/h4-9,12H,10-11,13H2,1-3H3