1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-6-(3-pyridylmethoxy)-4-[3-(2-thienyl)propanoyl]-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-(1-oxo-3-thiophen-2-ylpropyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(3-thiophen-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 1-p-anisyl-6-(3-pyridylmethoxy)-4-[3-(2-thienyl)propanoyl]-1,4-diazepan-2-one Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CCC3=CC=CS3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CCC3=CC=CS3)OCC4=CN=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-32-22-8-6-20(7-9-22)15-28-16-23(33-19-21-4-2-12-27-14-21)17-29(18-26(28)31)25(30)11-10-24-5-3-13-34-24/h2-9,12-14,23H,10-11,15-19H2,1H3