[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-piperazin-1-yl-methanone hydrochloride

Systemtic Name: [1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-piperazin-1-yl-methanone hydrochloride Openeye Name: [1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-piperazin-1-yl-methanone hydrochloride CAS Name: [1-(6-methoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-(1-piperazinyl)methanone hydrochloride IUPAC Name: [1-(6-methoxypyridin-3-yl)-5-phenylpyrazol-3-yl]-piperazin-1-ylmethanone hydrochloride Traditional Name: [1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-piperazino-methanone hydrochloride Formula: C20H22ClN5O2 MolecularWeight: 399.87398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCNCC3)C4=CC=CC=C4.Cl

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCNCC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C20H21N5O2.ClH/c1-27-19-8-7-16(14-22-19)25-18(15-5-3-2-4-6-15)13-17(23-25)20(26)24-11-9-21-10-12-24;/h2-8,13-14,21H,9-12H2,1H3;1H