N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[(1S)-2-methyl-1-[4-(o-tolylmethyl)piperazine-1-carbonyl]propyl]-2-phenoxy-acetamide CAS Name: N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[(2S)-3-methyl-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[(1S)-2-methyl-1-[4-(2-methylbenzyl)piperazine-1-carbonyl]propyl]-2-phenoxy-acetamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C(C(C)C)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3/c1-19(2)24(26-23(29)18-31-22-11-5-4-6-12-22)25(30)28-15-13-27(14-16-28)17-21-10-8-7-9-20(21)3/h4-12,19,24H,13-18H2,1-3H3,(H,26,29)/t24-/m0/s1