1-[[5-[(4-ethanoylpiperazin-1-yl)methyl]-2-methyl-phenyl]methyl]-1-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[[5-[(4-ethanoylpiperazin-1-yl)methyl]-2-methyl-phenyl]methyl]-1-(6-methylpyridin-3-yl)urea Openeye Name: 1-[[5-[(4-acetylpiperazin-1-yl)methyl]-2-methyl-phenyl]methyl]-1-(6-methyl-3-pyridyl)urea CAS Name: 1-[[5-[(4-acetyl-1-piperazinyl)methyl]-2-methylphenyl]methyl]-1-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[[5-[(4-acetylpiperazin-1-yl)methyl]-2-methylphenyl]methyl]-1-(6-methylpyridin-3-yl)urea Traditional Name: 1-[5-[(4-acetylpiperazino)methyl]-2-methyl-benzyl]-1-(6-methyl-3-pyridyl)urea Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C)CN(C3=CN=C(C=C3)C)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C)CN(C3=CN=C(C=C3)C)C(=O)N

InChI

InChI=1S/C22H29N5O2/c1-16-4-6-19(14-25-8-10-26(11-9-25)18(3)28)12-20(16)15-27(22(23)29)21-7-5-17(2)24-13-21/h4-7,12-13H,8-11,14-15H2,1-3H3,(H2,23,29)