6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(2-methylpyrazol-3-yl)carbonyl-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(2-methylpyrazol-3-yl)carbonyl-1,4-diazepan-2-one Openeye Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-[(2-methyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(cyclopropylmethoxy)-1-m-anisyl-4-(2-methylpyrazole-3-carbonyl)-1,4-diazepan-2-one Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CC(=CC=C3)OC)OCC4CC4

Isomeric SMILES

CN1C(=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CC(=CC=C3)OC)OCC4CC4

InChI

InChI=1S/C22H28N4O4/c1-24-20(8-9-23-24)22(28)26-13-19(30-15-16-6-7-16)12-25(21(27)14-26)11-17-4-3-5-18(10-17)29-2/h3-5,8-10,16,19H,6-7,11-15H2,1-2H3