methyl 4-(4-ethylphenyl)-2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethylphenyl)-2-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethylphenyl)-2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[4-(3-methyl-4-propan-2-ylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethylphenyl)-2-[4-(3-methyl-4-propan-2-ylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-[4-(4-isopropyl-3-methyl-phenoxy)butanoylamino]thiophene-3-carboxylic acid methyl ester Formula: C28H33NO4S MolecularWeight: 479.63092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCCOC3=CC(=C(C=C3)C(C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCCOC3=CC(=C(C=C3)C(C)C)C

InChI

InChI=1S/C28H33NO4S/c1-6-20-9-11-21(12-10-20)24-17-34-27(26(24)28(31)32-5)29-25(30)8-7-15-33-22-13-14-23(18(2)3)19(4)16-22/h9-14,16-18H,6-8,15H2,1-5H3,(H,29,30)