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

Systemtic Name: N-cyclohexyl-2-(3,4-dimethoxyphenyl)-2-[quinolin-3-yl(2-thiophen-2-ylethanoyl)amino]ethanamide Openeye Name: N-cyclohexyl-2-(3,4-dimethoxyphenyl)-2-[3-quinolyl-[2-(2-thienyl)acetyl]amino]acetamide CAS Name: N-cyclohexyl-2-(3,4-dimethoxyphenyl)-2-[(1-oxo-2-thiophen-2-ylethyl)-(3-quinolinyl)amino]acetamide IUPAC Name: N-cyclohexyl-2-(3,4-dimethoxyphenyl)-2-[quinolin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide Traditional Name: N-cyclohexyl-2-(3,4-dimethoxyphenyl)-2-[3-quinolyl-[2-(2-thienyl)acetyl]amino]acetamide Formula: C31H33N3O4S MolecularWeight: 543.67642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H33N3O4S/c1-37-27-15-14-22(18-28(27)38-2)30(31(36)33-23-10-4-3-5-11-23)34(29(35)19-25-12-8-16-39-25)24-17-21-9-6-7-13-26(21)32-20-24/h6-9,12-18,20,23,30H,3-5,10-11,19H2,1-2H3,(H,33,36)