(2S)-2-[(4-acetamidophenyl)-(2-thiophen-2-ylethanoyl)amino]-N-cyclohexyl-2-(3-methoxyphenyl)ethanamide

Systemtic Name: (2S)-2-[(4-acetamidophenyl)-(2-thiophen-2-ylethanoyl)amino]-N-cyclohexyl-2-(3-methoxyphenyl)ethanamide Openeye Name: (2S)-2-(4-acetamido-N-[2-(2-thienyl)acetyl]anilino)-N-cyclohexyl-2-(3-methoxyphenyl)acetamide CAS Name: (2S)-2-(4-acetamido-N-(1-oxo-2-thiophen-2-ylethyl)anilino)-N-cyclohexyl-2-(3-methoxyphenyl)acetamide IUPAC Name: (2S)-2-(4-acetamido-N-(2-thiophen-2-ylacetyl)anilino)-N-cyclohexyl-2-(3-methoxyphenyl)acetamide Traditional Name: (2S)-2-(4-acetamido-N-[2-(2-thienyl)acetyl]anilino)-N-cyclohexyl-2-(3-methoxyphenyl)acetamide Formula: C29H33N3O4S MolecularWeight: 519.65502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N(C(C2=CC(=CC=C2)OC)C(=O)NC3CCCCC3)C(=O)CC4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N([C@@H](C2=CC(=CC=C2)OC)C(=O)NC3CCCCC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C29H33N3O4S/c1-20(33)30-23-13-15-24(16-14-23)32(27(34)19-26-12-7-17-37-26)28(21-8-6-11-25(18-21)36-2)29(35)31-22-9-4-3-5-10-22/h6-8,11-18,22,28H,3-5,9-10,19H2,1-2H3,(H,30,33)(H,31,35)/t28-/m0/s1