(2S)-N-cyclohexyl-2-[2-(3-methylphenyl)ethyl-(2-thiophen-2-ylethanoyl)amino]-2-pyridin-3-yl-ethanamide

Systemtic Name: (2S)-N-cyclohexyl-2-[2-(3-methylphenyl)ethyl-(2-thiophen-2-ylethanoyl)amino]-2-pyridin-3-yl-ethanamide Openeye Name: (2S)-N-cyclohexyl-2-[2-(m-tolyl)ethyl-[2-(2-thienyl)acetyl]amino]-2-(3-pyridyl)acetamide CAS Name: (2S)-N-cyclohexyl-2-[2-(3-methylphenyl)ethyl-(1-oxo-2-thiophen-2-ylethyl)amino]-2-(3-pyridinyl)acetamide IUPAC Name: (2S)-N-cyclohexyl-2-[2-(3-methylphenyl)ethyl-(2-thiophen-2-ylacetyl)amino]-2-pyridin-3-ylacetamide Traditional Name: (2S)-N-cyclohexyl-2-[2-(m-tolyl)ethyl-[2-(2-thienyl)acetyl]amino]-2-(3-pyridyl)acetamide Formula: C28H33N3O2S MolecularWeight: 475.64552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCN(C(C2=CN=CC=C2)C(=O)NC3CCCCC3)C(=O)CC4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)CCN([C@@H](C2=CN=CC=C2)C(=O)NC3CCCCC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C28H33N3O2S/c1-21-8-5-9-22(18-21)14-16-31(26(32)19-25-13-7-17-34-25)27(23-10-6-15-29-20-23)28(33)30-24-11-3-2-4-12-24/h5-10,13,15,17-18,20,24,27H,2-4,11-12,14,16,19H2,1H3,(H,30,33)/t27-/m0/s1