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

Systemtic Name: methyl 5-(diethylcarbamoyl)-2-[(5-fluoranyl-2-methyl-phenyl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(diethylcarbamoyl)-2-[(5-fluoro-2-methyl-phenyl)carbamothioylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2-[[(5-fluoro-2-methylanilino)-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(diethylcarbamoyl)-2-[(5-fluoro-2-methylphenyl)carbamothioylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2-[(5-fluoro-2-methyl-phenyl)thiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H24FN3O3S2 MolecularWeight: 437.551263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=C(C=CC(=C2)F)C)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NC2=C(C=CC(=C2)F)C)C(=O)OC)C

InChI

InChI=1S/C20H24FN3O3S2/c1-6-24(7-2)18(25)16-12(4)15(19(26)27-5)17(29-16)23-20(28)22-14-10-13(21)9-8-11(14)3/h8-10H,6-7H2,1-5H3,(H2,22,23,28)