4-(5-ethanoylthiophen-3-yl)carbonyl-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(5-ethanoylthiophen-3-yl)carbonyl-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(5-acetylthiophene-3-carbonyl)-1-isobutyl-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[(5-acetyl-3-thiophenyl)-oxomethyl]-1-(2-methylpropyl)-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(5-acetylthiophene-3-carbonyl)-1-(2-methylpropyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(5-acetylthiophene-3-carbonyl)-1-isobutyl-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CSC(=C2)C(=O)C)OCC3=CC=CC=N3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CSC(=C2)C(=O)C)OCC3=CC=CC=N3

InChI

InChI=1S/C22H27N3O4S/c1-15(2)9-24-10-19(29-13-18-6-4-5-7-23-18)11-25(12-21(24)27)22(28)17-8-20(16(3)26)30-14-17/h4-8,14-15,19H,9-13H2,1-3H3