4-ethyl-1-(5-methylthiophen-2-yl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-ethyl-1-(5-methylthiophen-2-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-ethyl-1-(5-methylthiophene-2-carbonyl)-1,4-diazepan-5-one CAS Name: 4-ethyl-1-[(5-methyl-2-thiophenyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-ethyl-1-(5-methylthiophene-2-carbonyl)-1,4-diazepan-5-one Traditional Name: 4-ethyl-1-(5-methylthiophene-2-carbonyl)-1,4-diazepan-5-one Formula: C13H18N2O2S MolecularWeight: 266.35922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CCC1=O)C(=O)C2=CC=C(S2)C

Isomeric SMILES

CCN1CCN(CCC1=O)C(=O)C2=CC=C(S2)C

InChI

InChI=1S/C13H18N2O2S/c1-3-14-8-9-15(7-6-12(14)16)13(17)11-5-4-10(2)18-11/h4-5H,3,6-9H2,1-2H3