methyl 5-(diethylcarbamoyl)-2-[2-(2-methoxyphenyl)ethylcarbamothioylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[2-(2-methoxyphenyl)ethylcarbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[2-(2-methoxyphenyl)ethylcarbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[[2-(2-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[2-(2-methoxyphenyl)ethylcarbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[2-(2-methoxyphenyl)ethylthiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NCCC2=CC=CC=C2OC)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NCCC2=CC=CC=C2OC)C(=O)OC)C

InChI

InChI=1S/C22H29N3O4S2/c1-6-25(7-2)20(26)18-14(3)17(21(27)29-5)19(31-18)24-22(30)23-13-12-15-10-8-9-11-16(15)28-4/h8-11H,6-7,12-13H2,1-5H3,(H2,23,24,30)