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

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-(3-methoxypropylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-(3-methoxypropylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-(3-methoxypropylcarbamothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-(3-methoxypropylthiocarbamoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H27N3O4S2 MolecularWeight: 401.54398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O4S2/c1-6-20(7-2)15(21)13-11(3)12(16(22)24-5)14(26-13)19-17(25)18-9-8-10-23-4/h6-10H2,1-5H3,(H2,18,19,25)