2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide

Systemtic Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide Openeye Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide CAS Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetamide IUPAC Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide Traditional Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3-pyrrolidinoquinoxalin-2-yl)acetamide Formula: C24H27N5O5S MolecularWeight: 497.56668

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=NC2=CC=CC=C2N=C1N3CCCC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CN(CC(=O)NC1=NC2=CC=CC=C2N=C1N3CCCC3)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C24H27N5O5S/c1-28(35(31,32)17-9-10-20-21(15-17)34-14-6-13-33-20)16-22(30)27-23-24(29-11-4-5-12-29)26-19-8-3-2-7-18(19)25-23/h2-3,7-10,15H,4-6,11-14,16H2,1H3,(H,25,27,30)