4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-heptan-2-yl-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-heptan-2-yl-4-oxidanylidene-butanamide Openeye Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(1-methylhexyl)-4-oxo-butanamide CAS Name: 4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-heptan-2-yl-4-oxobutanamide IUPAC Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-heptan-2-yl-4-oxobutanamide Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-keto-N-(1-methylhexyl)butyramide Formula: C23H37N3O4S MolecularWeight: 451.62258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCCCC(C)NC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C23H37N3O4S/c1-5-6-7-8-20(4)24-22(27)11-12-23(28)25-13-15-26(16-14-25)31(29,30)21-17-18(2)9-10-19(21)3/h9-10,17,20H,5-8,11-16H2,1-4H3,(H,24,27)