N-[5-cyano-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzamide

Systemtic Name: N-[5-cyano-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzamide Openeye Name: N-[5-cyano-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzamide CAS Name: N-[5-cyano-2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]benzamide IUPAC Name: N-[5-cyano-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzamide Traditional Name: N-[5-cyano-2-(4-methylpiperazino)pyrimidin-4-yl]benzamide Formula: C17H18N6O MolecularWeight: 322.36442

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C(=N2)NC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C(=N2)NC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H18N6O/c1-22-7-9-23(10-8-22)17-19-12-14(11-18)15(21-17)20-16(24)13-5-3-2-4-6-13/h2-6,12H,7-10H2,1H3,(H,19,20,21,24)