2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[(6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-(6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C20H21N7OS MolecularWeight: 407.49204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C20H21N7OS/c1-12-18(13(2)26(4)25-12)24-17(28)11-29-20-16-10-21-27(15-8-6-5-7-9-15)19(16)22-14(3)23-20/h5-10H,11H2,1-4H3,(H,24,28)