N-(3,4-dimethoxyphenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C26H33N3O6S MolecularWeight: 515.62172

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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=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H33N3O6S/c1-18-6-9-21(10-7-18)36(32,33)28-15-12-19(13-16-28)26(31)29-14-4-5-22(29)25(30)27-20-8-11-23(34-2)24(17-20)35-3/h6-11,17,19,22H,4-5,12-16H2,1-3H3,(H,27,30)