3-[4-(4-aminophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[4-(4-aminophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-[4-(4-aminophenyl)piperazin-1-yl]-6-(p-tolyl)-2H-1,2,4-triazin-5-one CAS Name: 3-[4-(4-aminophenyl)-1-piperazinyl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-[4-(4-aminophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-[4-(4-aminophenyl)piperazino]-6-(p-tolyl)-2H-1,2,4-triazin-5-one Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=NC2=O)N3CCN(CC3)C4=CC=C(C=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=NC2=O)N3CCN(CC3)C4=CC=C(C=C4)N

InChI

InChI=1S/C20H22N6O/c1-14-2-4-15(5-3-14)18-19(27)22-20(24-23-18)26-12-10-25(11-13-26)17-8-6-16(21)7-9-17/h2-9H,10-13,21H2,1H3,(H,22,24,27)