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

Systemtic Name: methyl 5-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[(3-fluoro-4-methyl-phenyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 5-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-fluoro-4-methylphenyl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 5-[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C14H13FN2O2S2 MolecularWeight: 324.393623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(S2)C(=O)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(S2)C(=O)OC)F

InChI

InChI=1S/C14H13FN2O2S2/c1-8-3-4-9(7-10(8)15)16-14(20)17-12-6-5-11(21-12)13(18)19-2/h3-7H,1-2H3,(H2,16,17,20)