methyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(4-tert-butylphenoxy)-1-oxopropyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[2-(4-tert-butylphenoxy)propanoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C26H29NO4S MolecularWeight: 451.57776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C(C)OC2=CC=C(C=C2)C(C)(C)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C(C)OC2=CC=C(C=C2)C(C)(C)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C26H29NO4S/c1-16(31-20-14-12-19(13-15-20)26(3,4)5)23(28)27-24-22(25(29)30-6)21(17(2)32-24)18-10-8-7-9-11-18/h7-16H,1-6H3,(H,27,28)