1-[(4-methoxyphenyl)methyl]-4-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-[(5-methyl-1H-pyrazol-3-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-(5-methyl-1H-pyrazole-3-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-(5-methyl-1H-pyrazole-3-carbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(5-methyl-1H-pyrazole-3-carbonyl)-1-p-anisyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C24H27N5O4 MolecularWeight: 449.50228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

InChI

InChI=1S/C24H27N5O4/c1-17-10-22(27-26-17)24(31)29-14-21(33-16-19-4-3-9-25-11-19)13-28(23(30)15-29)12-18-5-7-20(32-2)8-6-18/h3-11,21H,12-16H2,1-2H3,(H,26,27)