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

Systemtic Name: 1-(3-methylphenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]urea Openeye Name: 1-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-[4-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]urea Traditional Name: 1-[4-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)amino]phenyl]-3-(m-tolyl)urea Formula: C23H26N6O MolecularWeight: 402.49214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)N4CCCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)N4CCCC4)C

InChI

InChI=1S/C23H26N6O/c1-16-6-5-7-20(14-16)27-23(30)26-19-10-8-18(9-11-19)25-22-24-17(2)15-21(28-22)29-12-3-4-13-29/h5-11,14-15H,3-4,12-13H2,1-2H3,(H,24,25,28)(H2,26,27,30)