(4-pyrimidin-2-ylpiperazin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[4-(1,2,4-triazol-1-yl)phenyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[4-(1,2,4-triazol-1-yl)phenyl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[4-(1,2,4-triazol-1-yl)phenyl]methanone Formula: C17H17N7O MolecularWeight: 335.36318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C17H17N7O/c25-16(14-2-4-15(5-3-14)24-13-18-12-21-24)22-8-10-23(11-9-22)17-19-6-1-7-20-17/h1-7,12-13H,8-11H2