N-(2-dimethylaminoethyl)-N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]ethanediamide

Systemtic Name: N-(2-dimethylaminoethyl)-N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]ethanediamide Openeye Name: N-(2-dimethylaminoethyl)-N'-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]oxamide CAS Name: N-(2-dimethylaminoethyl)-N'-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]oxamide IUPAC Name: N-(2-dimethylaminoethyl)-N'-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]oxamide Traditional Name: N-(2-dimethylaminoethyl)-N'-[2-(3-pyridyl)-2-tosyl-ethyl]oxamide Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O4S/c1-15-6-8-17(9-7-15)29(27,28)18(16-5-4-10-21-13-16)14-23-20(26)19(25)22-11-12-24(2)3/h4-10,13,18H,11-12,14H2,1-3H3,(H,22,25)(H,23,26)