methyl 2-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)C

InChI

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