ethyl 5-ethyl-2-[4-(4-propan-2-ylphenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[4-(4-propan-2-ylphenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[4-(4-isopropylphenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-4-(4-propan-2-ylphenoxy)butyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[4-(4-propan-2-ylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[4-(4-isopropylphenoxy)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C22H29NO4S MolecularWeight: 403.53496

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)C(C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)C(C)C)C(=O)OCC

InChI

InChI=1S/C22H29NO4S/c1-5-18-14-19(22(25)26-6-2)21(28-18)23-20(24)8-7-13-27-17-11-9-16(10-12-17)15(3)4/h9-12,14-15H,5-8,13H2,1-4H3,(H,23,24)