N'-(2,5-dimethylphenyl)-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]ethanediamide

Systemtic Name: N'-(2,5-dimethylphenyl)-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]ethanediamide Openeye Name: N'-(2,5-dimethylphenyl)-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]oxamide CAS Name: N'-(2,5-dimethylphenyl)-N-[2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]oxamide IUPAC Name: N'-(2,5-dimethylphenyl)-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]oxamide Traditional Name: N'-(2,5-dimethylphenyl)-N-[2-(4-pyrrolidinosulfonylphenyl)ethyl]oxamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27N3O4S/c1-16-5-6-17(2)20(15-16)24-22(27)21(26)23-12-11-18-7-9-19(10-8-18)30(28,29)25-13-3-4-14-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)(H,24,27)