methyl 4-(2-chlorophenyl)-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(2-chlorophenyl)-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[(cyclopropylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorophenyl)-2-(cyclopropylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-(cyclopropylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C16H15ClN2O2S2 MolecularWeight: 366.8855

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=S)NC3CC3

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=S)NC3CC3

InChI

InChI=1S/C16H15ClN2O2S2/c1-21-15(20)13-11(10-4-2-3-5-12(10)17)8-23-14(13)19-16(22)18-9-6-7-9/h2-5,8-9H,6-7H2,1H3,(H2,18,19,22)