ethyl 5-(dimethylcarbamoyl)-2-[2-[(3-fluorophenyl)amino]ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(dimethylcarbamoyl)-2-[2-[(3-fluorophenyl)amino]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(dimethylcarbamoyl)-2-[[2-(3-fluoroanilino)acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-[[2-(3-fluoroanilino)-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(dimethylcarbamoyl)-2-[[2-(3-fluoroanilino)acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[[2-(3-fluoroanilino)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H22FN3O4S MolecularWeight: 407.459083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CNC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)CNC2=CC(=CC=C2)F

InChI

InChI=1S/C19H22FN3O4S/c1-5-27-19(26)15-11(2)16(18(25)23(3)4)28-17(15)22-14(24)10-21-13-8-6-7-12(20)9-13/h6-9,21H,5,10H2,1-4H3,(H,22,24)