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

Systemtic Name: methyl 2-[[2,5-bis(fluoranyl)phenyl]carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,5-difluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2,5-difluoroanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,5-difluorophenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2,5-difluorophenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C14H12F2N2O2S2 MolecularWeight: 342.384086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)F)F)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=C(C=CC(=C2)F)F)C(=O)OC

InChI

InChI=1S/C14H12F2N2O2S2/c1-7-5-9(13(19)20-2)12(22-7)18-14(21)17-11-6-8(15)3-4-10(11)16/h3-6H,1-2H3,(H2,17,18,21)