N'-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenyl-propanehydrazide

Systemtic Name: N'-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenyl-propanehydrazide Openeye Name: N'-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenyl-propanehydrazide CAS Name: N'-[1-(3-chloro-4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-3-phenylpropanehydrazide IUPAC Name: N'-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenylpropanehydrazide Traditional Name: N'-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3-phenyl-propionohydrazide Formula: C21H19ClN6O MolecularWeight: 406.86816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)CCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NNC(=O)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C21H19ClN6O/c1-14-7-9-16(11-18(14)22)28-21-17(12-25-28)20(23-13-24-21)27-26-19(29)10-8-15-5-3-2-4-6-15/h2-7,9,11-13H,8,10H2,1H3,(H,26,29)(H,23,24,27)