ethyl 4-(4-chlorophenyl)-2-[4-(4-propylphenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[4-(4-propylphenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[4-(4-propylphenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[1-oxo-4-(4-propylphenoxy)butyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[4-(4-propylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[4-(4-propylphenoxy)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C26H28ClNO4S MolecularWeight: 486.02282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCCC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C26H28ClNO4S/c1-3-6-18-8-14-21(15-9-18)32-16-5-7-23(29)28-25-24(26(30)31-4-2)22(17-33-25)19-10-12-20(27)13-11-19/h8-15,17H,3-7,16H2,1-2H3,(H,28,29)