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

Systemtic Name: methyl 5-(butylcarbamoyl)-2-[(4-fluorophenyl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(butylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-[butylamino(oxo)methyl]-2-[[(4-fluorophenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(butylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-(butylcarbamoyl)-2-[(4-fluorobenzoyl)amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C19H21FN2O4S MolecularWeight: 392.444443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)F)C(=O)OC)C

Isomeric SMILES

CCCCNC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)F)C(=O)OC)C

InChI

InChI=1S/C19H21FN2O4S/c1-4-5-10-21-17(24)15-11(2)14(19(25)26-3)18(27-15)22-16(23)12-6-8-13(20)9-7-12/h6-9H,4-5,10H2,1-3H3,(H,21,24)(H,22,23)