2-[4-(4-butoxypyrimidin-2-yl)piperazin-1-yl]carbonylpyridine-3-carbonitrile

Systemtic Name: 2-[4-(4-butoxypyrimidin-2-yl)piperazin-1-yl]carbonylpyridine-3-carbonitrile Openeye Name: 2-[4-(4-butoxypyrimidin-2-yl)piperazine-1-carbonyl]pyridine-3-carbonitrile CAS Name: 2-[[4-(4-butoxy-2-pyrimidinyl)-1-piperazinyl]-oxomethyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-butoxypyrimidin-2-yl)piperazine-1-carbonyl]pyridine-3-carbonitrile Traditional Name: 2-[4-(4-butoxypyrimidin-2-yl)piperazine-1-carbonyl]nicotinonitrile Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC=C1)N2CCN(CC2)C(=O)C3=C(C=CC=N3)C#N

Isomeric SMILES

CCCCOC1=NC(=NC=C1)N2CCN(CC2)C(=O)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C19H22N6O2/c1-2-3-13-27-16-6-8-22-19(23-16)25-11-9-24(10-12-25)18(26)17-15(14-20)5-4-7-21-17/h4-8H,2-3,9-13H2,1H3