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

Systemtic Name: methyl 2-[[2,4-bis(fluoranyl)phenyl]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-difluorophenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[(2,4-difluoroanilino)-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-difluorophenyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(2,4-difluorophenyl)thiocarbamoylamino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C15H14F2N2O2S2 MolecularWeight: 356.410666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14F2N2O2S2/c1-3-9-7-10(14(20)21-2)13(23-9)19-15(22)18-12-5-4-8(16)6-11(12)17/h4-7H,3H2,1-2H3,(H2,18,19,22)