methyl 3-(4-chloranylbutanoylamino)-5-(4-chlorophenyl)thiophene-2-carboxylate

Systemtic Name: methyl 3-(4-chloranylbutanoylamino)-5-(4-chlorophenyl)thiophene-2-carboxylate Openeye Name: methyl 3-(4-chlorobutanoylamino)-5-(4-chlorophenyl)thiophene-2-carboxylate CAS Name: 3-[(4-chloro-1-oxobutyl)amino]-5-(4-chlorophenyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorobutanoylamino)-5-(4-chlorophenyl)thiophene-2-carboxylate Traditional Name: 3-(4-chlorobutanoylamino)-5-(4-chlorophenyl)thiophene-2-carboxylic acid methyl ester Formula: C16H15Cl2NO3S MolecularWeight: 372.2662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CCCCl

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CCCCl

InChI

InChI=1S/C16H15Cl2NO3S/c1-22-16(21)15-12(19-14(20)3-2-8-17)9-13(23-15)10-4-6-11(18)7-5-10/h4-7,9H,2-3,8H2,1H3,(H,19,20)