N-[6-[4-(2-methoxyphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[6-[4-(2-methoxyphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[6-[4-(2-methoxybenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-(2-thienyl)acetamide CAS Name: N-[6-[4-[(2-methoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]-3-pyridinyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[6-[4-(2-methoxybenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[6-(4-o-anisoyl-1,4-diazepan-1-yl)-3-pyridyl]-2-(2-thienyl)acetamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C24H26N4O3S/c1-31-21-8-3-2-7-20(21)24(30)28-12-5-11-27(13-14-28)22-10-9-18(17-25-22)26-23(29)16-19-6-4-15-32-19/h2-4,6-10,15,17H,5,11-14,16H2,1H3,(H,26,29)