4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)-4-oxo-butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-4-oxobutanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-4-oxobutanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-N-(4-methyl-3-morpholinosulfonyl-phenyl)butyramide Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H28N2O7S/c1-17-3-5-19(16-23(17)34(29,30)26-9-13-31-14-10-26)25-24(28)8-6-20(27)18-4-7-21-22(15-18)33-12-2-11-32-21/h3-5,7,15-16H,2,6,8-14H2,1H3,(H,25,28)