N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(oxolan-2-ylmethyl)ethanediamide

Systemtic Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(oxolan-2-ylmethyl)ethanediamide Openeye Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(tetrahydrofuran-2-ylmethyl)oxamide CAS Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-N-(2-oxolanylmethyl)oxamide IUPAC Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-N-(oxolan-2-ylmethyl)oxamide Traditional Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(tetrahydrofurfuryl)oxamide Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2CCCO2)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCC2CCCO2)C3=CN=CC=C3)C

InChI

InChI=1S/C22H27N3O5S/c1-15-7-8-19(11-16(15)2)31(28,29)20(17-5-3-9-23-12-17)14-25-22(27)21(26)24-13-18-6-4-10-30-18/h3,5,7-9,11-12,18,20H,4,6,10,13-14H2,1-2H3,(H,24,26)(H,25,27)