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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-morpholinosulfonyl-2-pyrrolidin-1-yl-benzamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-morpholinosulfonyl-2-pyrrolidino-benzamide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)NC4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)NC4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C24H29N3O6S/c28-24(25-18-4-7-22-23(16-18)33-13-3-12-32-22)20-17-19(5-6-21(20)26-8-1-2-9-26)34(29,30)27-10-14-31-15-11-27/h4-7,16-17H,1-3,8-15H2,(H,25,28)