[2-(tert-butylamino)-2-oxidanylidene-ethyl]-[2-[(3-ethoxycarbonyl-5-ethyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[2-[(3-ethoxycarbonyl-5-ethyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[2-[(3-ethoxycarbonyl-5-ethyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[2-[(3-ethoxycarbonyl-5-ethyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[2-[(3-ethoxycarbonyl-5-ethyl-4-methylthiophen-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[2-[(3-carbethoxy-5-ethyl-4-methyl-2-thienyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H32N3O4S+ MolecularWeight: 398.54008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)C[NH+](C)CC(=O)NC(C)(C)C)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)C[NH+](C)CC(=O)NC(C)(C)C)C(=O)OCC)C

InChI

InChI=1S/C19H31N3O4S/c1-8-13-12(3)16(18(25)26-9-2)17(27-13)20-14(23)10-22(7)11-15(24)21-19(4,5)6/h8-11H2,1-7H3,(H,20,23)(H,21,24)/p+1