methyl 2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H19ClN2O4S2 MolecularWeight: 414.92676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl)C

InChI

InChI=1S/C17H19ClN2O4S2/c1-8-9(2)26-15(14(8)16(21)24-5)20-17(25)19-11-6-10(18)12(22-3)7-13(11)23-4/h6-7H,1-5H3,(H2,19,20,25)