methyl 3-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2,5-dichlorophenyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-[[(2,5-dichloroanilino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2,5-dichlorophenyl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-[(2,5-dichlorophenyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C13H10Cl2N2O2S2 MolecularWeight: 361.2667

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=S)NC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=S)NC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C13H10Cl2N2O2S2/c1-19-12(18)11-9(4-5-21-11)16-13(20)17-10-6-7(14)2-3-8(10)15/h2-6H,1H3,(H2,16,17,20)