2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-[(2R)-1-(4-ethoxybenzyl)-3-keto-piperazin-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCNC(=O)C2CC(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCNC(=O)[C@H]2CC(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C21H29N5O3/c1-2-29-18-6-4-17(5-7-18)15-26-13-10-24-21(28)19(26)14-20(27)23-8-3-11-25-12-9-22-16-25/h4-7,9,12,16,19H,2-3,8,10-11,13-15H2,1H3,(H,23,27)(H,24,28)/t19-/m1/s1