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

Systemtic Name: (2S)-N-cyclohexyl-2-(3-methoxyphenyl)-2-[phenethyl(2-thiophen-2-ylethanoyl)amino]ethanamide Openeye Name: (2S)-N-cyclohexyl-2-(3-methoxyphenyl)-2-[phenethyl-[2-(2-thienyl)acetyl]amino]acetamide CAS Name: (2S)-N-cyclohexyl-2-(3-methoxyphenyl)-2-[(1-oxo-2-thiophen-2-ylethyl)-phenethylamino]acetamide IUPAC Name: (2S)-N-cyclohexyl-2-(3-methoxyphenyl)-2-[phenethyl-(2-thiophen-2-ylacetyl)amino]acetamide Traditional Name: (2S)-N-cyclohexyl-2-(3-methoxyphenyl)-2-[phenethyl-[2-(2-thienyl)acetyl]amino]acetamide Formula: C29H34N2O3S MolecularWeight: 490.65686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)NC2CCCCC2)N(CCC3=CC=CC=C3)C(=O)CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)[C@@H](C(=O)NC2CCCCC2)N(CCC3=CC=CC=C3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C29H34N2O3S/c1-34-25-15-8-12-23(20-25)28(29(33)30-24-13-6-3-7-14-24)31(18-17-22-10-4-2-5-11-22)27(32)21-26-16-9-19-35-26/h2,4-5,8-12,15-16,19-20,24,28H,3,6-7,13-14,17-18,21H2,1H3,(H,30,33)/t28-/m0/s1