[2-(2-methylpropyl)piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone

Systemtic Name: [2-(2-methylpropyl)piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone Openeye Name: (2-isobutylpiperazin-1-yl)-[5-(4-pyridyl)pyrimidin-2-yl]methanone CAS Name: [2-(2-methylpropyl)-1-piperazinyl]-(5-pyridin-4-yl-2-pyrimidinyl)methanone IUPAC Name: [2-(2-methylpropyl)piperazin-1-yl]-(5-pyridin-4-ylpyrimidin-2-yl)methanone Traditional Name: (2-isobutylpiperazino)-[5-(4-pyridyl)pyrimidin-2-yl]methanone Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CNCCN1C(=O)C2=NC=C(C=N2)C3=CC=NC=C3

Isomeric SMILES

CC(C)CC1CNCCN1C(=O)C2=NC=C(C=N2)C3=CC=NC=C3

InChI

InChI=1S/C18H23N5O/c1-13(2)9-16-12-20-7-8-23(16)18(24)17-21-10-15(11-22-17)14-3-5-19-6-4-14/h3-6,10-11,13,16,20H,7-9,12H2,1-2H3