3-methyl-N-(5-methyl-3-oxidanylidene-1-phenyl-2-propan-2-ylsulfonyl-hexyl)butanamide

Systemtic Name: 3-methyl-N-(5-methyl-3-oxidanylidene-1-phenyl-2-propan-2-ylsulfonyl-hexyl)butanamide Openeye Name: N-(2-isopropylsulfonyl-5-methyl-3-oxo-1-phenyl-hexyl)-3-methyl-butanamide CAS Name: 3-methyl-N-(5-methyl-3-oxo-1-phenyl-2-propan-2-ylsulfonylhexyl)butanamide IUPAC Name: 3-methyl-N-(5-methyl-3-oxo-1-phenyl-2-propan-2-ylsulfonylhexyl)butanamide Traditional Name: N-(2-isopropylsulfonyl-3-keto-5-methyl-1-phenyl-hexyl)-3-methyl-butyramide Formula: C21H33NO4S MolecularWeight: 395.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C1=CC=CC=C1)NC(=O)CC(C)C)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)CC(=O)C(C(C1=CC=CC=C1)NC(=O)CC(C)C)S(=O)(=O)C(C)C

InChI

InChI=1S/C21H33NO4S/c1-14(2)12-18(23)21(27(25,26)16(5)6)20(17-10-8-7-9-11-17)22-19(24)13-15(3)4/h7-11,14-16,20-21H,12-13H2,1-6H3,(H,22,24)