methyl 2-[[2,4-bis(bromanyl)-6-fluoranyl-phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2,4-bis(bromanyl)-6-fluoranyl-phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-dibromo-6-fluoro-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(2,4-dibromo-6-fluoroanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-dibromo-6-fluorophenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2,4-dibromo-6-fluoro-phenyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C15H13Br2FN2O2S2 MolecularWeight: 496.212323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C=C(C=C2F)Br)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=C(C=C(C=C2F)Br)Br)C

InChI

InChI=1S/C15H13Br2FN2O2S2/c1-6-7(2)24-13(11(6)14(21)22-3)20-15(23)19-12-9(17)4-8(16)5-10(12)18/h4-5H,1-3H3,(H2,19,20,23)