N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C26H32ClN3O6S MolecularWeight: 550.06678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4OC)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4OC)OC)Cl

InChI

InChI=1S/C26H32ClN3O6S/c1-17-6-8-19(9-7-17)37(33,34)29-13-10-18(11-14-29)26(32)30-12-4-5-22(30)25(31)28-21-15-20(27)23(35-2)16-24(21)36-3/h6-9,15-16,18,22H,4-5,10-14H2,1-3H3,(H,28,31)