6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-4-(2-thiophen-2-ylethanoyl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-4-(2-thiophen-2-ylethanoyl)-1,4-diazepan-2-one Openeye Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-pyridylmethyl)-4-[2-(2-thienyl)acetyl]-1,4-diazepan-2-one CAS Name: 6-[(3-methoxyphenyl)methoxy]-4-(1-oxo-2-thiophen-2-ylethyl)-1-(2-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-4-(2-thiophen-2-ylacetyl)-1,4-diazepan-2-one Traditional Name: 6-m-anisyloxy-1-(2-pyridylmethyl)-4-[2-(2-thienyl)acetyl]-1,4-diazepan-2-one Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CC3=CC=CC=N3)C(=O)CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CC3=CC=CC=N3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C25H27N3O4S/c1-31-21-8-4-6-19(12-21)18-32-22-15-27(14-20-7-2-3-10-26-20)25(30)17-28(16-22)24(29)13-23-9-5-11-33-23/h2-12,22H,13-18H2,1H3