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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(6-methyl-4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-(6-methyl-4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(6-methyl-4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(4-keto-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C21H18ClN5O2 MolecularWeight: 407.85292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)Cl

InChI

InChI=1S/C21H18ClN5O2/c1-13-8-9-15(10-18(13)22)25-19(28)12-26-14(2)24-20-17(21(26)29)11-23-27(20)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,25,28)