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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)N)C3=NC(=O)C(=NN3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)N)C3=NC(=O)C(=NN3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N6O/c21-16-6-8-17(9-7-16)25-10-12-26(13-11-25)20-22-19(27)18(23-24-20)14-15-4-2-1-3-5-15/h1-9H,10-14,21H2,(H,22,24,27)