N-[(4-chlorophenyl)methyl]-3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-3-(6-methyl-4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-[(4-chlorophenyl)methyl]-3-(6-methyl-4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3-(6-methyl-4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(4-chlorobenzyl)-3-(4-keto-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C22H20ClN5O2 MolecularWeight: 421.8795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O2/c1-15-26-21-19(14-25-28(21)18-5-3-2-4-6-18)22(30)27(15)12-11-20(29)24-13-16-7-9-17(23)10-8-16/h2-10,14H,11-13H2,1H3,(H,24,29)