ethyl 4-(4-bromophenyl)-2-[2-(2-propan-2-ylphenoxy)ethanoylcarbamothioylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[2-(2-propan-2-ylphenoxy)ethanoylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[[2-(2-isopropylphenoxy)acetyl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[[[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[[2-(2-propan-2-ylphenoxy)acetyl]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[[2-(2-isopropylphenoxy)acetyl]thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25BrN2O4S2 MolecularWeight: 561.511

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=S)NC(=O)COC3=CC=CC=C3C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=S)NC(=O)COC3=CC=CC=C3C(C)C

InChI

InChI=1S/C25H25BrN2O4S2/c1-4-31-24(30)22-19(16-9-11-17(26)12-10-16)14-34-23(22)28-25(33)27-21(29)13-32-20-8-6-5-7-18(20)15(2)3/h5-12,14-15H,4,13H2,1-3H3,(H2,27,28,29,33)