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

Systemtic Name: 2-methyl-5-[4-[2-(1H-1,2,4-triazol-5-yl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 2-methyl-5-[4-[2-(1H-1,2,4-triazol-5-yl)benzoyl]piperazin-1-yl]pyridazin-3-one CAS Name: 2-methyl-5-[4-[oxo-[2-(1H-1,2,4-triazol-5-yl)phenyl]methyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-methyl-5-[4-[2-(1H-1,2,4-triazol-5-yl)benzoyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 2-methyl-5-[4-[2-(1H-1,2,4-triazol-5-yl)benzoyl]piperazino]pyridazin-3-one Formula: C18H19N7O2 MolecularWeight: 365.38916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3C4=NC=NN4

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3C4=NC=NN4

InChI

InChI=1S/C18H19N7O2/c1-23-16(26)10-13(11-21-23)24-6-8-25(9-7-24)18(27)15-5-3-2-4-14(15)17-19-12-20-22-17/h2-5,10-12H,6-9H2,1H3,(H,19,20,22)