N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-4-phenyl-benzamide

Systemtic Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-4-phenyl-benzamide Openeye Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-4-phenyl-benzamide CAS Name: N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-4-phenylbenzamide IUPAC Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-4-phenylbenzamide Traditional Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-4-phenyl-benzamide Formula: C28H21N7O MolecularWeight: 471.51264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=NC=NC5=C4C=NN5C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=NC=NC5=C4C=NN5C6=CC=CC=C6

InChI

InChI=1S/C28H21N7O/c1-19-16-25(32-28(36)22-14-12-21(13-15-22)20-8-4-2-5-9-20)35(33-19)27-24-17-31-34(26(24)29-18-30-27)23-10-6-3-7-11-23/h2-18H,1H3,(H,32,36)