1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-4-[3-(2-thienyl)propanoyl]-1,4-diazepan-2-one CAS Name: 1-(4-oxanylmethyl)-4-(1-oxo-3-thiophen-2-ylpropyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-(oxan-4-ylmethyl)-6-(pyridin-4-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-(4-pyridylmethoxy)-1-(tetrahydropyran-4-ylmethyl)-4-[3-(2-thienyl)propanoyl]-1,4-diazepan-2-one Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CC(CN(CC2=O)C(=O)CCC3=CC=CS3)OCC4=CC=NC=C4

Isomeric SMILES

C1COCCC1CN2CC(CN(CC2=O)C(=O)CCC3=CC=CS3)OCC4=CC=NC=C4

InChI

InChI=1S/C24H31N3O4S/c28-23(4-3-22-2-1-13-32-22)27-16-21(31-18-20-5-9-25-10-6-20)15-26(24(29)17-27)14-19-7-11-30-12-8-19/h1-2,5-6,9-10,13,19,21H,3-4,7-8,11-12,14-18H2