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

Systemtic Name: ethyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-fluorobenzyl)thiocarbamoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H17FN2O2S2 MolecularWeight: 352.446783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C16H17FN2O2S2/c1-3-21-15(20)14-10(2)8-13(23-14)19-16(22)18-9-11-4-6-12(17)7-5-11/h4-8H,3,9H2,1-2H3,(H2,18,19,22)