propan-2-yl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-(2,4-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-(2,4-dimethylphenyl)thiophene-3-carboxylate Openeye Name: isopropyl 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-(2,4-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-4-(2,4-dimethylphenyl)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-4-(2,4-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-(2,4-dimethylphenyl)thiophene-3-carboxylic acid isopropyl ester Formula: C27H30ClNO4S MolecularWeight: 500.0494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C)C

InChI

InChI=1S/C27H30ClNO4S/c1-16(2)33-27(31)25-22(21-10-8-17(3)13-18(21)4)15-34-26(25)29-24(30)7-6-12-32-23-11-9-20(28)14-19(23)5/h8-11,13-16H,6-7,12H2,1-5H3,(H,29,30)