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

Systemtic Name: ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: ethyl-[2-(ethylamino)-2-oxo-ethyl]-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: ethyl-[2-(ethylamino)-2-oxoethyl]-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: ethyl-[2-(ethylamino)-2-oxoethyl]-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: ethyl-[2-(ethylamino)-2-keto-ethyl]-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]ammonium Formula: C17H27N4O3S+ MolecularWeight: 367.48628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4O3S/c1-3-18-15(22)12-19(4-2)13-16(23)20-7-9-21(10-8-20)17(24)14-6-5-11-25-14/h5-6,11H,3-4,7-10,12-13H2,1-2H3,(H,18,22)/p+1