1-(3-chlorophenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]urea Openeye Name: 1-(3-chlorophenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]urea CAS Name: 1-(3-chlorophenyl)-3-[4-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[4-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)amino]phenyl]urea Formula: C22H23ClN6O MolecularWeight: 422.91062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)N4CCCC4

InChI

InChI=1S/C22H23ClN6O/c1-15-13-20(29-11-2-3-12-29)28-21(24-15)25-17-7-9-18(10-8-17)26-22(30)27-19-6-4-5-16(23)14-19/h4-10,13-14H,2-3,11-12H2,1H3,(H,24,25,28)(H2,26,27,30)