2-(4-chloranyl-2,6-dimethyl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-chloranyl-2,6-dimethyl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]ethanamide Openeye Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]acetamide CAS Name: 2-(4-chloro-2,6-dimethylphenoxy)-N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]acetamide IUPAC Name: 2-(4-chloro-2,6-dimethylphenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]acetamide Traditional Name: 2-(4-chloro-2,6-dimethyl-phenoxy)-N-[6-(4-methylpiperazino)-3-pyridyl]acetamide Formula: C20H25ClN4O2 MolecularWeight: 388.8911

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C)C)Cl

InChI

InChI=1S/C20H25ClN4O2/c1-14-10-16(21)11-15(2)20(14)27-13-19(26)23-17-4-5-18(22-12-17)25-8-6-24(3)7-9-25/h4-5,10-12H,6-9,13H2,1-3H3,(H,23,26)