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

Systemtic Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-N-(3-methoxypropyl)ethanediamide Openeye Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(3-methoxypropyl)oxamide CAS Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-N-(3-methoxypropyl)oxamide IUPAC Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]-N-(3-methoxypropyl)oxamide Traditional Name: N'-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]-N-(3-methoxypropyl)oxamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O5S/c1-15-7-8-18(12-16(15)2)30(27,28)19(17-6-4-9-22-13-17)14-24-21(26)20(25)23-10-5-11-29-3/h4,6-9,12-13,19H,5,10-11,14H2,1-3H3,(H,23,25)(H,24,26)