(2S,3R)-5-methyl-3-(4-phenylpiperazin-1-yl)carbonyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-5-methyl-3-(4-phenylpiperazin-1-yl)carbonyl-2-propyl-hexanamide Openeye Name: (2S,3R)-5-methyl-3-(4-phenylpiperazine-1-carbonyl)-2-propyl-hexanamide CAS Name: (2S,3R)-5-methyl-3-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-propylhexanamide IUPAC Name: (2S,3R)-5-methyl-3-(4-phenylpiperazine-1-carbonyl)-2-propylhexanamide Traditional Name: (2S,3R)-5-methyl-3-(4-phenylpiperazine-1-carbonyl)-2-propyl-hexanamide Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O2/c1-4-8-18(20(22)25)19(15-16(2)3)21(26)24-13-11-23(12-14-24)17-9-6-5-7-10-17/h5-7,9-10,16,18-19H,4,8,11-15H2,1-3H3,(H2,22,25)/t18-,19+/m0/s1