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

Systemtic Name: 1-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-3-phenyl-urea Openeye Name: 1-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-3-phenyl-urea CAS Name: 1-(2-phenethyl-6-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-phenylurea IUPAC Name: 1-(2-phenethyl-6-phenylpyrazolo[3,4-d]pyrimidin-4-yl)-3-phenylurea Traditional Name: 1-(2-phenethyl-6-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-3-phenyl-urea Formula: C26H22N6O MolecularWeight: 434.49248

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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)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H22N6O/c33-26(27-21-14-8-3-9-15-21)30-24-22-18-32(17-16-19-10-4-1-5-11-19)31-25(22)29-23(28-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H2,27,28,29,30,31,33)