4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]butanamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]butanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]butanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[4-(2-ketopyrrolidino)-3-methyl-phenyl]butyramide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)N4CCCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)N4CCCC4=O

InChI

InChI=1S/C24H29N3O6S/c1-17-15-18(7-9-20(17)27-12-3-6-24(27)29)26-23(28)5-2-11-25-34(30,31)19-8-10-21-22(16-19)33-14-4-13-32-21/h7-10,15-16,25H,2-6,11-14H2,1H3,(H,26,28)