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

Systemtic Name: 4-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitro-benzamide CAS Name: 4-methyl-N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitro-benzamide Formula: C23H18N8O3 MolecularWeight: 454.44082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NN2C3=NC=NC4=C3C=NN4C5=CC=CC=C5)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=NN2C3=NC=NC4=C3C=NN4C5=CC=CC=C5)C)[N+](=O)[O-]

InChI

InChI=1S/C23H18N8O3/c1-14-8-9-16(11-19(14)31(33)34)23(32)27-20-10-15(2)28-30(20)22-18-12-26-29(21(18)24-13-25-22)17-6-4-3-5-7-17/h3-13H,1-2H3,(H,27,32)