methyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C22H19Cl2NO4S MolecularWeight: 464.36156

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H19Cl2NO4S/c1-28-22(27)20-16(14-6-3-2-4-7-14)13-30-21(20)25-19(26)8-5-11-29-18-10-9-15(23)12-17(18)24/h2-4,6-7,9-10,12-13H,5,8,11H2,1H3,(H,25,26)