(1,5-diphenyl-1,2,4-triazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C23H21N7O MolecularWeight: 411.45914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H21N7O/c31-22(28-14-16-29(17-15-28)23-24-12-7-13-25-23)20-26-21(18-8-3-1-4-9-18)30(27-20)19-10-5-2-6-11-19/h1-13H,14-17H2