1,3-dimethyl-4-(4-methylpiperazin-1-yl)-N-[(3-phenylphenyl)carbamoyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1,3-dimethyl-4-(4-methylpiperazin-1-yl)-N-[(3-phenylphenyl)carbamoyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1,3-dimethyl-4-(4-methylpiperazin-1-yl)-N-[(3-phenylphenyl)carbamoyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1,3-dimethyl-4-(4-methyl-1-piperazinyl)-N-[oxo-(3-phenylanilino)methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-4-(4-methylpiperazin-1-yl)-N-[(3-phenylphenyl)carbamoyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1,3-dimethyl-4-(4-methylpiperazino)-N-[(3-phenylphenyl)carbamoyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C27H29N7O2 MolecularWeight: 483.56486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)N3CCN(CC3)C)C(=O)NC(=O)NC4=CC=CC(=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)N3CCN(CC3)C)C(=O)NC(=O)NC4=CC=CC(=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C27H29N7O2/c1-18-23-24(34-14-12-32(2)13-15-34)22(17-28-25(23)33(3)31-18)26(35)30-27(36)29-21-11-7-10-20(16-21)19-8-5-4-6-9-19/h4-11,16-17H,12-15H2,1-3H3,(H2,29,30,35,36)