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

Systemtic Name: methyl 2-[4-(4-chloranylphenoxy)butanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[4-(4-chlorophenoxy)butanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[4-(4-chlorophenoxy)-1-oxobutyl]amino]-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-chlorophenoxy)butanoylamino]-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[4-(4-chlorophenoxy)butanoylamino]-4-(4-fluorophenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C23H21ClFNO4S MolecularWeight: 461.933543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)Cl)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)Cl)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H21ClFNO4S/c1-14-20(15-5-9-17(25)10-6-15)21(23(28)29-2)22(31-14)26-19(27)4-3-13-30-18-11-7-16(24)8-12-18/h5-12H,3-4,13H2,1-2H3,(H,26,27)