[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] thieno[3,2-b][1]benzothiole-2-carboxylate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] thieno[3,2-b]benzothiophene-2-carboxylate CAS Name: 2-thieno[3,2-b][1]benzothiolecarboxylic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Traditional Name: thieno[3,2-b]benzothiophene-2-carboxylic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O4S2/c1-18(2,3)20-17(23)19-14(21)9-24-16(22)13-8-12-15(26-13)10-6-4-5-7-11(10)25-12/h4-8H,9H2,1-3H3,(H2,19,20,21,23)