N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(1-piperidylsulfonyl)-2-pyrrolidin-1-yl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(1-piperidinylsulfonyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-piperidinosulfonyl-2-pyrrolidino-benzamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)NC4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)NC4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C25H31N3O5S/c29-25(26-19-7-10-23-24(17-19)33-16-6-15-32-23)21-18-20(8-9-22(21)27-11-4-5-12-27)34(30,31)28-13-2-1-3-14-28/h7-10,17-18H,1-6,11-16H2,(H,26,29)