[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl]-ethyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-ethyl-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]ammonium Formula: C18H27N4O5S+ MolecularWeight: 411.49578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC(=O)OCC)CC(=O)N1CCN(CC1)C(=O)C2=CC=CS2

Isomeric SMILES

CC[NH+](CC(=O)NC(=O)OCC)CC(=O)N1CCN(CC1)C(=O)C2=CC=CS2

InChI

InChI=1S/C18H26N4O5S/c1-3-20(12-15(23)19-18(26)27-4-2)13-16(24)21-7-9-22(10-8-21)17(25)14-6-5-11-28-14/h5-6,11H,3-4,7-10,12-13H2,1-2H3,(H,19,23,26)/p+1