N-[4-[[4-[(3-chlorophenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]methanamide

Systemtic Name: N-[4-[[4-[(3-chlorophenyl)amino]-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]methanamide Openeye Name: N-[4-[[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]formamide CAS Name: N-[4-[[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]formamide IUPAC Name: N-[4-[[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]formamide Traditional Name: N-[4-[[4-(3-chloroanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]amino]phenyl]formamide Formula: C18H14ClN7O MolecularWeight: 379.80306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)NC4=CC=C(C=C4)NC=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)NC4=CC=C(C=C4)NC=O

InChI

InChI=1S/C18H14ClN7O/c19-11-2-1-3-14(8-11)24-16-15-17(21-9-20-16)25-26-18(15)23-13-6-4-12(5-7-13)22-10-27/h1-10H,(H,22,27)(H3,20,21,23,24,25,26)