2-[(2S)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]ethanamide

Systemtic Name: 2-[(2S)-1-[(3-methoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]ethanamide Openeye Name: 2-[(2S)-1-[(3-methoxyphenyl)methyl]-3-oxo-piperazin-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide CAS Name: 2-[(2S)-1-[(3-methoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide IUPAC Name: 2-[(2S)-1-[(3-methoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide Traditional Name: 2-[(2S)-3-keto-1-m-anisyl-piperazin-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=C1)CN(C)C(=O)CC2C(=O)NCCN2CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCC1=NNC(=C1)CN(C)C(=O)C[C@H]2C(=O)NCCN2CC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H31N5O3/c1-4-6-17-12-18(25-24-17)15-26(2)21(28)13-20-22(29)23-9-10-27(20)14-16-7-5-8-19(11-16)30-3/h5,7-8,11-12,20H,4,6,9-10,13-15H2,1-3H3,(H,23,29)(H,24,25)/t20-/m0/s1