1-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-(2,1,3-benzoxadiazol-4-ylsulfonyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 1-(4-benzofurazan-4-ylsulfonyl-1,4-diazepan-1-yl)ethanone Formula: C13H16N4O4S MolecularWeight: 324.35554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)S(=O)(=O)C2=CC=CC3=NON=C32

Isomeric SMILES

CC(=O)N1CCCN(CC1)S(=O)(=O)C2=CC=CC3=NON=C32

InChI

InChI=1S/C13H16N4O4S/c1-10(18)16-6-3-7-17(9-8-16)22(19,20)12-5-2-4-11-13(12)15-21-14-11/h2,4-5H,3,6-9H2,1H3