N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(3-imidazol-1-ylpropyl)ethanediamide

Systemtic Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(3-imidazol-1-ylpropyl)ethanediamide Openeye Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(3-imidazol-1-ylpropyl)oxamide CAS Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-N-[3-(1-imidazolyl)propyl]oxamide IUPAC Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-N-(3-imidazol-1-ylpropyl)oxamide Traditional Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(3-imidazol-1-ylpropyl)oxamide Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCCN2C=CN=C2)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCCN2C=CN=C2)C3=CN=CC=C3)C

InChI

InChI=1S/C23H27N5O4S/c1-17-6-7-20(13-18(17)2)33(31,32)21(19-5-3-8-24-14-19)15-27-23(30)22(29)26-9-4-11-28-12-10-25-16-28/h3,5-8,10,12-14,16,21H,4,9,11,15H2,1-2H3,(H,26,29)(H,27,30)