(2S,3R)-5-methyl-3-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-5-methyl-3-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-2-propyl-hexanamide Openeye Name: (2S,3R)-5-methyl-3-[4-(m-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide CAS Name: (2S,3R)-5-methyl-3-[[4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]-2-propylhexanamide IUPAC Name: (2S,3R)-5-methyl-3-[4-(3-methylphenyl)piperazine-1-carbonyl]-2-propylhexanamide Traditional Name: (2S,3R)-5-methyl-3-[4-(m-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCN(CC1)C2=CC=CC(=C2)C)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCN(CC1)C2=CC=CC(=C2)C)C(=O)N

InChI

InChI=1S/C22H35N3O2/c1-5-7-19(21(23)26)20(14-16(2)3)22(27)25-12-10-24(11-13-25)18-9-6-8-17(4)15-18/h6,8-9,15-16,19-20H,5,7,10-14H2,1-4H3,(H2,23,26)/t19-,20+/m0/s1