2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-isopropyl-acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-propan-2-ylacetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-2-keto-1,3-benzoxazol-3-yl]-N-isopropyl-acetamide Formula: C18H25N3O5S MolecularWeight: 395.4732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)OC1=O

Isomeric SMILES

CC(C)NC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCCC3)OC1=O

InChI

InChI=1S/C18H25N3O5S/c1-13(2)19-17(22)12-21-15-8-7-14(11-16(15)26-18(21)23)27(24,25)20-9-5-3-4-6-10-20/h7-8,11,13H,3-6,9-10,12H2,1-2H3,(H,19,22)