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

Systemtic Name: 1-[[5-[(4-ethanoylpiperazin-1-yl)methyl]-2-methyl-phenyl]methyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[[5-[(4-acetylpiperazin-1-yl)methyl]-2-methyl-phenyl]methyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[[5-[(4-acetyl-1-piperazinyl)methyl]-2-methylphenyl]methyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[[5-[(4-acetylpiperazin-1-yl)methyl]-2-methylphenyl]methyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[5-[(4-acetylpiperazino)methyl]-2-methyl-benzyl]-3-(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)CNC(=O)NC3=CN=C(C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C)CNC(=O)NC3=CN=C(C=C3)C

InChI

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