methyl 2-[[2-[bis(fluoranyl)methoxy]-4-methyl-phenyl]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-[bis(fluoranyl)methoxy]-4-methyl-phenyl]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(difluoromethoxy)-4-methyl-phenyl]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(difluoromethoxy)-4-methylanilino]-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(difluoromethoxy)-4-methylphenyl]carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(difluoromethoxy)-4-methyl-phenyl]thiocarbamoylamino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H18F2N2O3S2 MolecularWeight: 400.463226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2=C(C=C(C=C2)C)OC(F)F)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=C(C=C(C=C2)C)OC(F)F)C(=O)OC

InChI

InChI=1S/C17H18F2N2O3S2/c1-4-10-8-11(15(22)23-3)14(26-10)21-17(25)20-12-6-5-9(2)7-13(12)24-16(18)19/h5-8,16H,4H2,1-3H3,(H2,20,21,25)