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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4S2/c1-10(2)8-19-18(23)20-15(21)9-24-17(22)14-7-13-16(26-14)11-5-3-4-6-12(11)25-13/h3-7,10H,8-9H2,1-2H3,(H2,19,20,21,23)