2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxidanylidene-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-2-keto-1,3-benzoxazol-3-yl]-N-(3,5-dimethoxyphenyl)acetamide Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCCC4)OC2=O)OC

InChI

InChI=1S/C23H27N3O7S/c1-31-17-11-16(12-18(13-17)32-2)24-22(27)15-26-20-8-7-19(14-21(20)33-23(26)28)34(29,30)25-9-5-3-4-6-10-25/h7-8,11-14H,3-6,9-10,15H2,1-2H3,(H,24,27)