2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]ethanamide Openeye Name: 2-(4-chloro-2-isopropyl-5-methyl-phenoxy)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]acetamide CAS Name: 2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]acetamide IUPAC Name: 2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]acetamide Traditional Name: 2-(4-chloro-2-isopropyl-5-methyl-phenoxy)-N-[6-(4-methylpiperazino)-3-pyridyl]acetamide Formula: C22H29ClN4O2 MolecularWeight: 416.94426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C22H29ClN4O2/c1-15(2)18-12-19(23)16(3)11-20(18)29-14-22(28)25-17-5-6-21(24-13-17)27-9-7-26(4)8-10-27/h5-6,11-13,15H,7-10,14H2,1-4H3,(H,25,28)