N-(3-methylbutyl)-N'-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]ethanediamide

Systemtic Name: N-(3-methylbutyl)-N'-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]ethanediamide Openeye Name: N-isopentyl-N'-[[1-(p-tolylsulfonyl)pyrrolidin-2-yl]methyl]oxamide CAS Name: N-(3-methylbutyl)-N'-[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methyl]oxamide IUPAC Name: N-(3-methylbutyl)-N'-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]oxamide Traditional Name: N-isoamyl-N'-[(1-tosylpyrrolidin-2-yl)methyl]oxamide Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CNC(=O)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CNC(=O)C(=O)NCCC(C)C

InChI

InChI=1S/C19H29N3O4S/c1-14(2)10-11-20-18(23)19(24)21-13-16-5-4-12-22(16)27(25,26)17-8-6-15(3)7-9-17/h6-9,14,16H,4-5,10-13H2,1-3H3,(H,20,23)(H,21,24)