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

Systemtic Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-2-methylsulfanyl-benzamide Openeye Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-2-methylsulfanyl-benzamide CAS Name: N-[5-methyl-2-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-3-pyrazolyl]-2-(methylthio)benzamide IUPAC Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-2-methylsulfanylbenzamide Traditional Name: N-[5-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)pyrazol-3-yl]-2-(methylthio)benzamide Formula: C23H19N7OS MolecularWeight: 441.50826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2SC)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2SC)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H19N7OS/c1-15-12-20(27-23(31)17-10-6-7-11-19(17)32-2)30(28-15)22-18-13-26-29(21(18)24-14-25-22)16-8-4-3-5-9-16/h3-14H,1-2H3,(H,27,31)