2-[4-[[1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(1-benzyltriazole-4-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[oxo-[1-(phenylmethyl)-4-triazolyl]methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(1-benzyltriazole-4-carbonyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(1-benzyltriazole-4-carbonyl)piperazino]isonicotinonitrile Formula: C20H19N7O MolecularWeight: 373.41116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C20H19N7O/c21-13-17-6-7-22-19(12-17)25-8-10-26(11-9-25)20(28)18-15-27(24-23-18)14-16-4-2-1-3-5-16/h1-7,12,15H,8-11,14H2