(3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(1,3-benzodioxol-5-yl)-5-oxo-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-(1,3-benzodioxol-5-yl)-5-keto-N-(2-piperidinosulfonylbenzyl)pyrrolidine-3-carboxamide Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)[C@H]3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H27N3O6S/c28-23-12-18(15-27(23)19-8-9-20-21(13-19)33-16-32-20)24(29)25-14-17-6-2-3-7-22(17)34(30,31)26-10-4-1-5-11-26/h2-3,6-9,13,18H,1,4-5,10-12,14-16H2,(H,25,29)/t18-/m0/s1