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

Systemtic Name: methyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-fluorophenyl)methylcarbamothioylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-fluorobenzyl)thiocarbamoylamino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C15H15FN2O2S2 MolecularWeight: 338.420203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=S)NCC2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=S)NCC2=CC=C(C=C2)F)C(=O)OC

InChI

InChI=1S/C15H15FN2O2S2/c1-9-7-12(22-13(9)14(19)20-2)18-15(21)17-8-10-3-5-11(16)6-4-10/h3-7H,8H2,1-2H3,(H2,17,18,21)