1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenyl-5-pyrazolo[3,4-b]pyridinecarbonitrile IUPAC Name: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 1-(4-chlorophenyl)-4-(4-methoxyphenyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C27H19ClN4O MolecularWeight: 450.91896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(=N2)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(=N2)C3=CC=CC=C3)C#N)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H19ClN4O/c1-17-24-25(18-8-14-22(33-2)15-9-18)23(16-29)26(19-6-4-3-5-7-19)30-27(24)32(31-17)21-12-10-20(28)11-13-21/h3-15H,1-2H3