ethyl 2-[2-(3-chloranylphenoxy)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-chloranylphenoxy)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(3-chlorophenoxy)propanoylamino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-chlorophenoxy)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[2-(3-chlorophenoxy)propanoylamino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H22ClNO4S MolecularWeight: 443.94308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(C)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(C)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H22ClNO4S/c1-4-28-23(27)20-19(16-10-8-14(2)9-11-16)13-30-22(20)25-21(26)15(3)29-18-7-5-6-17(24)12-18/h5-13,15H,4H2,1-3H3,(H,25,26)