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

Systemtic Name: 1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea Openeye Name: 1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea CAS Name: 1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)urea IUPAC Name: 1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenylpyrazolo[3,4-d]pyrimidin-4-yl)urea Traditional Name: 1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)urea Formula: C27H24N6O2 MolecularWeight: 464.51846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=NC3=NN(C=C32)CCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=NC3=NN(C=C32)CCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24N6O2/c1-35-22-14-12-21(13-15-22)28-27(34)31-25-23-18-33(17-16-19-8-4-2-5-9-19)32-26(23)30-24(29-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H2,28,29,30,31,32,34)