3-[(6-chloranyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-methoxy-4-methyl-benzamide

Systemtic Name: 3-[(6-chloranyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-methoxy-4-methyl-benzamide Openeye Name: 3-[(6-chloro-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-methoxy-4-methyl-benzamide CAS Name: 3-[(6-chloro-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-N-methoxy-4-methylbenzamide IUPAC Name: 3-[(6-chloro-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-methoxy-4-methylbenzamide Traditional Name: 3-[(6-chloro-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-methoxy-4-methyl-benzamide Formula: C20H17ClN6O2 MolecularWeight: 408.84098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NOC)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NOC)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H17ClN6O2/c1-12-8-9-13(19(28)26-29-2)10-16(12)23-17-15-11-22-27(14-6-4-3-5-7-14)18(15)25-20(21)24-17/h3-11H,1-2H3,(H,26,28)(H,23,24,25)