ethyl 2-[[2-[bis(fluoranyl)methoxy]-5-methyl-phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-[bis(fluoranyl)methoxy]-5-methyl-phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(difluoromethoxy)-5-methyl-phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(difluoromethoxy)-5-methylanilino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(difluoromethoxy)-5-methylphenyl]carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(difluoromethoxy)-5-methyl-phenyl]thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H20F2N2O3S2 MolecularWeight: 462.532606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=C(C=CC(=C3)C)OC(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=C(C=CC(=C3)C)OC(F)F

InChI

InChI=1S/C22H20F2N2O3S2/c1-3-28-20(27)15-12-18(14-7-5-4-6-8-14)31-19(15)26-22(30)25-16-11-13(2)9-10-17(16)29-21(23)24/h4-12,21H,3H2,1-2H3,(H2,25,26,30)