4-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-yl-pyrazol-3-yl]-1,4-diazepan-5-one

Systemtic Name: 4-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-yl-pyrazol-3-yl]-1,4-diazepan-5-one Openeye Name: 4-[1-(6-methoxy-3-pyridyl)-5-(2-pyridyl)pyrazol-3-yl]-1,4-diazepan-5-one CAS Name: 4-[1-(6-methoxy-3-pyridinyl)-5-(2-pyridinyl)-3-pyrazolyl]-1,4-diazepan-5-one IUPAC Name: 4-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-ylpyrazol-3-yl]-1,4-diazepan-5-one Traditional Name: 4-[1-(6-methoxy-3-pyridyl)-5-(2-pyridyl)pyrazol-3-yl]-1,4-diazepan-5-one Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)N3CCNCCC3=O)C4=CC=CC=N4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)N3CCNCCC3=O)C4=CC=CC=N4

InChI

InChI=1S/C19H20N6O2/c1-27-18-6-5-14(13-22-18)25-16(15-4-2-3-8-21-15)12-17(23-25)24-11-10-20-9-7-19(24)26/h2-6,8,12-13,20H,7,9-11H2,1H3