N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C27H30N6O MolecularWeight: 454.5667

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CN=C4C(=C3)C=NN4CC5=CC=CC=C5)C

InChI

InChI=1S/C27H30N6O/c1-3-31-11-13-32(14-12-31)24-9-10-25(20(2)15-24)30-27(34)23-16-22-18-29-33(26(22)28-17-23)19-21-7-5-4-6-8-21/h4-10,15-18H,3,11-14,19H2,1-2H3,(H,30,34)