1-cyclohexyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea

Systemtic Name: 1-cyclohexyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-cyclohexyl-3-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]urea CAS Name: 1-cyclohexyl-3-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]urea IUPAC Name: 1-cyclohexyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-cyclohexyl-3-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]urea Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H31N5O/c29-23(25-20-6-2-1-3-7-20)26-21-11-9-19(10-12-21)18-27-14-16-28(17-15-27)22-8-4-5-13-24-22/h4-5,8-13,20H,1-3,6-7,14-18H2,(H2,25,26,29)