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

Systemtic Name: 2-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitro-benzamide CAS Name: 2-methyl-N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-3-nitrobenzamide Traditional Name: 2-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=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

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