N-methyl-N-[(3-methylpyridin-4-yl)methyl]-2-[(2S)-3-oxidanylidene-1-phenethyl-piperazin-2-yl]ethanamide

Systemtic Name: N-methyl-N-[(3-methylpyridin-4-yl)methyl]-2-[(2S)-3-oxidanylidene-1-phenethyl-piperazin-2-yl]ethanamide Openeye Name: N-methyl-N-[(3-methyl-4-pyridyl)methyl]-2-[(2S)-3-oxo-1-phenethyl-piperazin-2-yl]acetamide CAS Name: N-methyl-N-[(3-methyl-4-pyridinyl)methyl]-2-[(2S)-3-oxo-1-phenethyl-2-piperazinyl]acetamide IUPAC Name: N-methyl-N-[(3-methylpyridin-4-yl)methyl]-2-[(2S)-3-oxo-1-phenethylpiperazin-2-yl]acetamide Traditional Name: 2-[(2S)-3-keto-1-phenethyl-piperazin-2-yl]-N-methyl-N-[(3-methyl-4-pyridyl)methyl]acetamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)CN(C)C(=O)CC2C(=O)NCCN2CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CN=C1)CN(C)C(=O)C[C@H]2C(=O)NCCN2CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2/c1-17-15-23-10-8-19(17)16-25(2)21(27)14-20-22(28)24-11-13-26(20)12-9-18-6-4-3-5-7-18/h3-8,10,15,20H,9,11-14,16H2,1-2H3,(H,24,28)/t20-/m0/s1