methyl 4-cyclohexyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-cyclohexyl-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-cyclohexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclohexyl-2-[[1-oxo-2-(3-phenoxyphenyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyclohexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclohexyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2CCCCC2)NC(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2CCCCC2)NC(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H27NO4S/c1-30-26(29)24-22(19-10-4-2-5-11-19)17-32-25(24)27-23(28)16-18-9-8-14-21(15-18)31-20-12-6-3-7-13-20/h3,6-9,12-15,17,19H,2,4-5,10-11,16H2,1H3,(H,27,28)