1-[4-(2-chlorophenyl)-6-methyl-2-phenyl-pyrimidin-5-yl]-3-(4-dimethylaminophenyl)urea

Systemtic Name: 1-[4-(2-chlorophenyl)-6-methyl-2-phenyl-pyrimidin-5-yl]-3-(4-dimethylaminophenyl)urea Openeye Name: 1-[4-(2-chlorophenyl)-6-methyl-2-phenyl-pyrimidin-5-yl]-3-(4-dimethylaminophenyl)urea CAS Name: 1-[4-(2-chlorophenyl)-6-methyl-2-phenyl-5-pyrimidinyl]-3-(4-dimethylaminophenyl)urea IUPAC Name: 1-[4-(2-chlorophenyl)-6-methyl-2-phenylpyrimidin-5-yl]-3-(4-dimethylaminophenyl)urea Traditional Name: 1-[4-(2-chlorophenyl)-6-methyl-2-phenyl-pyrimidin-5-yl]-3-(4-dimethylaminophenyl)urea Formula: C26H24ClN5O MolecularWeight: 457.95466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1NC(=O)NC2=CC=C(C=C2)N(C)C)C3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC(=C1NC(=O)NC2=CC=C(C=C2)N(C)C)C3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H24ClN5O/c1-17-23(31-26(33)29-19-13-15-20(16-14-19)32(2)3)24(21-11-7-8-12-22(21)27)30-25(28-17)18-9-5-4-6-10-18/h4-16H,1-3H3,(H2,29,31,33)