1-propan-2-yl-3-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]methyl]urea

Systemtic Name: 1-propan-2-yl-3-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]methyl]urea Openeye Name: 1-isopropyl-3-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]urea CAS Name: 1-[[4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-propan-2-yl-3-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]urea Traditional Name: 1-isopropyl-3-[4-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzyl]urea Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C20H26N6O2/c1-15(2)24-20(28)23-14-16-4-6-17(7-5-16)18(27)25-10-12-26(13-11-25)19-21-8-3-9-22-19/h3-9,15H,10-14H2,1-2H3,(H2,23,24,28)