2-(2-adamantylideneamino)oxy-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]ethanamide

Systemtic Name: 2-(2-adamantylideneamino)oxy-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]ethanamide Openeye Name: 2-(2-adamantylideneamino)oxy-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide CAS Name: 2-(2-adamantylideneamino)oxy-N-[3-(1-azepanylsulfonyl)-4-methylphenyl]acetamide IUPAC Name: 2-(2-adamantylideneamino)oxy-N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]acetamide Traditional Name: 2-(2-adamantylideneamino)oxy-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CON=C2C3CC4CC(C3)CC2C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CON=C2C3CC4CC(C3)CC2C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C25H35N3O4S/c1-17-6-7-22(15-23(17)33(30,31)28-8-4-2-3-5-9-28)26-24(29)16-32-27-25-20-11-18-10-19(13-20)14-21(25)12-18/h6-7,15,18-21H,2-5,8-14,16H2,1H3,(H,26,29)