2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-[2-(dimethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-[2-(dimethylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]-N-(2-thenyl)acetamide Formula: C16H26N4O2S MolecularWeight: 338.46824

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)CC(=O)NCC2=CC=CS2

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)CC(=O)NCC2=CC=CS2

InChI

InChI=1S/C16H26N4O2S/c1-18(2)16(22)13-20-7-4-6-19(8-9-20)12-15(21)17-11-14-5-3-10-23-14/h3,5,10H,4,6-9,11-13H2,1-2H3,(H,17,21)