1-(3-chloranyl-4-methyl-phenyl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]urea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]urea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[3-[4-(2-pyrimidyl)piperazino]propyl]urea Formula: C19H25ClN6O MolecularWeight: 388.8944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)Cl

InChI

InChI=1S/C19H25ClN6O/c1-15-4-5-16(14-17(15)20)24-19(27)23-8-3-9-25-10-12-26(13-11-25)18-21-6-2-7-22-18/h2,4-7,14H,3,8-13H2,1H3,(H2,23,24,27)