1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea

Systemtic Name: 1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea Openeye Name: 1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea CAS Name: 1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)urea IUPAC Name: 1-(3-chlorophenyl)-3-(2-phenethyl-6-phenylpyrazolo[3,4-d]pyrimidin-4-yl)urea Traditional Name: 1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea Formula: C26H21ClN6O MolecularWeight: 468.93754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=C3C(=N2)N=C(N=C3NC(=O)NC4=CC(=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=C3C(=N2)N=C(N=C3NC(=O)NC4=CC(=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H21ClN6O/c27-20-12-7-13-21(16-20)28-26(34)31-24-22-17-33(15-14-18-8-3-1-4-9-18)32-25(22)30-23(29-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H2,28,29,30,31,32,34)