ethyl 4-ethyl-2-[(4-fluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-[(4-fluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-[(4-fluorophenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-[(4-fluorophenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-2-[(4-fluorophenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H19FN2O2S2 MolecularWeight: 366.473363

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NC2=CC=C(C=C2)F)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NC2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H19FN2O2S2/c1-4-13-10(3)24-15(14(13)16(21)22-5-2)20-17(23)19-12-8-6-11(18)7-9-12/h6-9H,4-5H2,1-3H3,(H2,19,20,23)