[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-methyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]-methyl-ammonium Formula: C18H29N4O3S+ MolecularWeight: 381.51286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O3S/c1-18(2,3)19-15(23)12-20(4)13-16(24)21-7-9-22(10-8-21)17(25)14-6-5-11-26-14/h5-6,11H,7-10,12-13H2,1-4H3,(H,19,23)/p+1