2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]-N-(2-oxidanylideneazepan-3-yl)ethanamide

Systemtic Name: 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]-N-(2-oxidanylideneazepan-3-yl)ethanamide Openeye Name: 2-[(3-methylisoxazol-5-yl)methylsulfonyl]-N-(2-oxoazepan-3-yl)acetamide CAS Name: 2-[(3-methyl-5-isoxazolyl)methylsulfonyl]-N-(2-oxo-3-azepanyl)acetamide IUPAC Name: 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]-N-(2-oxoazepan-3-yl)acetamide Traditional Name: N-(2-ketoazepan-3-yl)-2-[(3-methylisoxazol-5-yl)methylsulfonyl]acetamide Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CS(=O)(=O)CC(=O)NC2CCCCNC2=O

Isomeric SMILES

CC1=NOC(=C1)CS(=O)(=O)CC(=O)NC2CCCCNC2=O

InChI

InChI=1S/C13H19N3O5S/c1-9-6-10(21-16-9)7-22(19,20)8-12(17)15-11-4-2-3-5-14-13(11)18/h6,11H,2-5,7-8H2,1H3,(H,14,18)(H,15,17)