N-(2,6-dimethylphenyl)-2-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[1-(3-pyridyl)ethyl]piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[1-(3-pyridinyl)ethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(1-pyridin-3-ylethyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[1-(3-pyridyl)ethyl]piperazino]acetamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(C)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(C)C3=CN=CC=C3

InChI

InChI=1S/C21H28N4O/c1-16-6-4-7-17(2)21(16)23-20(26)15-24-10-12-25(13-11-24)18(3)19-8-5-9-22-14-19/h4-9,14,18H,10-13,15H2,1-3H3,(H,23,26)