(2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[quinolin-3-yl(2-thiophen-2-ylethanoyl)amino]ethanamide

Systemtic Name: (2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[quinolin-3-yl(2-thiophen-2-ylethanoyl)amino]ethanamide Openeye Name: (2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[3-quinolyl-[2-(2-thienyl)acetyl]amino]acetamide CAS Name: (2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[(1-oxo-2-thiophen-2-ylethyl)-(3-quinolinyl)amino]acetamide IUPAC Name: (2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[quinolin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide Traditional Name: (2R)-N-cyclohexyl-2-(4-methoxyphenyl)-2-[3-quinolyl-[2-(2-thienyl)acetyl]amino]acetamide Formula: C30H31N3O3S MolecularWeight: 513.65044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3=CC4=CC=CC=C4N=C3)C(=O)CC5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C(=O)NC2CCCCC2)N(C3=CC4=CC=CC=C4N=C3)C(=O)CC5=CC=CS5

InChI

InChI=1S/C30H31N3O3S/c1-36-25-15-13-21(14-16-25)29(30(35)32-23-9-3-2-4-10-23)33(28(34)19-26-11-7-17-37-26)24-18-22-8-5-6-12-27(22)31-20-24/h5-8,11-18,20,23,29H,2-4,9-10,19H2,1H3,(H,32,35)/t29-/m1/s1