methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-methylpropylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-methylpropylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-(isobutylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-4-methyl-2-[[(2-methylpropylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-methylpropylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(isobutylthiocarbamoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H27N3O3S2 MolecularWeight: 385.54458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3S2/c1-7-20(8-2)15(21)13-11(5)12(16(22)23-6)14(25-13)19-17(24)18-9-10(3)4/h10H,7-9H2,1-6H3,(H2,18,19,24)