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

Systemtic Name: 1-tert-butyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-tert-butyl-3-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]urea CAS Name: 1-tert-butyl-3-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]urea IUPAC Name: 1-tert-butyl-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-tert-butyl-3-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]urea Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C21H29N5O/c1-21(2,3)24-20(27)23-18-9-7-17(8-10-18)16-25-12-14-26(15-13-25)19-6-4-5-11-22-19/h4-11H,12-16H2,1-3H3,(H2,23,24,27)