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

Systemtic Name: (2S,3R)-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]carbonyl-5-methyl-2-propyl-hexanamide Openeye Name: (2S,3R)-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carbonyl]-5-methyl-2-propyl-hexanamide CAS Name: (2S,3R)-3-[[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-oxomethyl]-5-methyl-2-propylhexanamide IUPAC Name: (2S,3R)-3-[4-[(4-chlorophenyl)-phenylmethyl]piperazine-1-carbonyl]-5-methyl-2-propylhexanamide Traditional Name: (2S,3R)-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazine-1-carbonyl]-5-methyl-2-propyl-hexanamide Formula: C28H38ClN3O2 MolecularWeight: 484.07322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)N

InChI

InChI=1S/C28H38ClN3O2/c1-4-8-24(27(30)33)25(19-20(2)3)28(34)32-17-15-31(16-18-32)26(21-9-6-5-7-10-21)22-11-13-23(29)14-12-22/h5-7,9-14,20,24-26H,4,8,15-19H2,1-3H3,(H2,30,33)/t24-,25+,26?/m0/s1