6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-4-(4-thiophen-2-ylbutanoyl)-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-4-(4-thiophen-2-ylbutanoyl)-1,4-diazepan-2-one Openeye Name: 6-(cyclopropylmethoxy)-1-(3-pyridylmethyl)-4-[4-(2-thienyl)butanoyl]-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-4-(1-oxo-4-thiophen-2-ylbutyl)-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-4-(4-thiophen-2-ylbutanoyl)-1,4-diazepan-2-one Traditional Name: 6-(cyclopropylmethoxy)-1-(3-pyridylmethyl)-4-[4-(2-thienyl)butanoyl]-1,4-diazepan-2-one Formula: C23H29N3O3S MolecularWeight: 427.55966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2CN(CC(=O)N(C2)CC3=CN=CC=C3)C(=O)CCCC4=CC=CS4

Isomeric SMILES

C1CC1COC2CN(CC(=O)N(C2)CC3=CN=CC=C3)C(=O)CCCC4=CC=CS4

InChI

InChI=1S/C23H29N3O3S/c27-22(7-1-5-21-6-3-11-30-21)26-15-20(29-17-18-8-9-18)14-25(23(28)16-26)13-19-4-2-10-24-12-19/h2-4,6,10-12,18,20H,1,5,7-9,13-17H2