1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-4-thiophen-2-ylcarbonyl-1,4-diazepan-2-one

Systemtic Name: 1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-4-thiophen-2-ylcarbonyl-1,4-diazepan-2-one Openeye Name: 1-isobutyl-6-(3-pyridylmethoxy)-4-(thiophene-2-carbonyl)-1,4-diazepan-2-one CAS Name: 1-(2-methylpropyl)-4-[oxo(thiophen-2-yl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(2-methylpropyl)-6-(pyridin-3-ylmethoxy)-4-(thiophene-2-carbonyl)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-6-(3-pyridylmethoxy)-4-(2-thenoyl)-1,4-diazepan-2-one Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CC=CS2)OCC3=CN=CC=C3

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C(=O)C2=CC=CS2)OCC3=CN=CC=C3

InChI

InChI=1S/C20H25N3O3S/c1-15(2)10-22-11-17(26-14-16-5-3-7-21-9-16)12-23(13-19(22)24)20(25)18-6-4-8-27-18/h3-9,15,17H,10-14H2,1-2H3