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

Systemtic Name: (2S,3R)-5-methyl-3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonyl-2-propyl-hexanamide Openeye Name: (2S,3R)-5-methyl-3-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide CAS Name: (2S,3R)-5-methyl-3-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]-2-propylhexanamide IUPAC Name: (2S,3R)-5-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-2-propylhexanamide Traditional Name: (2S,3R)-5-methyl-3-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-2-propyl-hexanamide Formula: C23H37N3O2 MolecularWeight: 387.55878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCN(C(C1)C)C2=CC=CC(=C2)C)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCN(C(C1)C)C2=CC=CC(=C2)C)C(=O)N

InChI

InChI=1S/C23H37N3O2/c1-6-8-20(22(24)27)21(13-16(2)3)23(28)25-11-12-26(18(5)15-25)19-10-7-9-17(4)14-19/h7,9-10,14,16,18,20-21H,6,8,11-13,15H2,1-5H3,(H2,24,27)/t18?,20-,21+/m0/s1