[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate CAS Name: 2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]acetic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate Traditional Name: 2-[(5-methylthiophene-2-carbonyl)amino]acetic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C17H24N2O4S MolecularWeight: 352.44846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC(=O)OC(C)C(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC(=O)OC(C)C(=O)N2CCCCCC2

InChI

InChI=1S/C17H24N2O4S/c1-12-7-8-14(24-12)16(21)18-11-15(20)23-13(2)17(22)19-9-5-3-4-6-10-19/h7-8,13H,3-6,9-11H2,1-2H3,(H,18,21)