methyl 2-[(2,4-dichlorophenyl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2,4-dichlorophenyl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-dichlorophenyl)methylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-dichlorophenyl)methylcarbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2,4-dichlorobenzyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C16H16Cl2N2O2S2 MolecularWeight: 403.34644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=C(C=C(C=C2)Cl)Cl)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=C(C=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C16H16Cl2N2O2S2/c1-8-9(2)24-14(13(8)15(21)22-3)20-16(23)19-7-10-4-5-11(17)6-12(10)18/h4-6H,7H2,1-3H3,(H2,19,20,23)