methyl 5-(diethylcarbamoyl)-2-(3,3-dimethylbutan-2-ylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-(3,3-dimethylbutan-2-ylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-(1,2,2-trimethylpropylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[(3,3-dimethylbutan-2-ylamino)-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-(3,3-dimethylbutan-2-ylcarbamothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-4-methyl-2-(1,2,2-trimethylpropylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C19H31N3O3S2 MolecularWeight: 413.59774

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC(C)C(C)(C)C)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC(C)C(C)(C)C)C(=O)OC)C

InChI

InChI=1S/C19H31N3O3S2/c1-9-22(10-2)16(23)14-11(3)13(17(24)25-8)15(27-14)21-18(26)20-12(4)19(5,6)7/h12H,9-10H2,1-8H3,(H2,20,21,26)