2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)ethanamide Openeye Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide CAS Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-[3-(1-pyrazolyl)propyl]acetamide IUPAC Name: 2-[(2R)-1-[(2-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide Traditional Name: 2-[(2R)-1-(2-ethoxybenzyl)-3-keto-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCNC(=O)C2CC(=O)NCCCN3C=CC=N3

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCNC(=O)[C@H]2CC(=O)NCCCN3C=CC=N3

InChI

InChI=1S/C21H29N5O3/c1-2-29-19-8-4-3-7-17(19)16-25-14-11-23-21(28)18(25)15-20(27)22-9-5-12-26-13-6-10-24-26/h3-4,6-8,10,13,18H,2,5,9,11-12,14-16H2,1H3,(H,22,27)(H,23,28)/t18-/m1/s1