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

Systemtic Name: 4-[5-(4-fluorophenyl)-1-(6-methoxypyridin-3-yl)pyrazol-3-yl]-1-methyl-1,4-diazepan-5-one Openeye Name: 4-[5-(4-fluorophenyl)-1-(6-methoxy-3-pyridyl)pyrazol-3-yl]-1-methyl-1,4-diazepan-5-one CAS Name: 4-[5-(4-fluorophenyl)-1-(6-methoxy-3-pyridinyl)-3-pyrazolyl]-1-methyl-1,4-diazepan-5-one IUPAC Name: 4-[5-(4-fluorophenyl)-1-(6-methoxypyridin-3-yl)pyrazol-3-yl]-1-methyl-1,4-diazepan-5-one Traditional Name: 4-[5-(4-fluorophenyl)-1-(6-methoxy-3-pyridyl)pyrazol-3-yl]-1-methyl-1,4-diazepan-5-one Formula: C21H22FN5O2 MolecularWeight: 395.430083

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)N(CC1)C2=NN(C(=C2)C3=CC=C(C=C3)F)C4=CN=C(C=C4)OC

Isomeric SMILES

CN1CCC(=O)N(CC1)C2=NN(C(=C2)C3=CC=C(C=C3)F)C4=CN=C(C=C4)OC

InChI

InChI=1S/C21H22FN5O2/c1-25-10-9-21(28)26(12-11-25)19-13-18(15-3-5-16(22)6-4-15)27(24-19)17-7-8-20(29-2)23-14-17/h3-8,13-14H,9-12H2,1-2H3