2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile hydrochloride

Systemtic Name: 2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile hydrochloride Openeye Name: 2-[4-(4-methoxypyrimidin-2-yl)piperazine-1-carbonyl]benzonitrile hydrochloride CAS Name: 2-[[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]-oxomethyl]benzonitrile hydrochloride IUPAC Name: 2-[4-(4-methoxypyrimidin-2-yl)piperazine-1-carbonyl]benzonitrile hydrochloride Traditional Name: 2-[4-(4-methoxypyrimidin-2-yl)piperazine-1-carbonyl]benzonitrile hydrochloride Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C#N.Cl

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C#N.Cl

InChI

InChI=1S/C17H17N5O2.ClH/c1-24-15-6-7-19-17(20-15)22-10-8-21(9-11-22)16(23)14-5-3-2-4-13(14)12-18;/h2-7H,8-11H2,1H3;1H