N-(3-chlorophenyl)-3-[(E)-furan-3-ylmethylideneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-chlorophenyl)-3-[(E)-furan-3-ylmethylideneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-chlorophenyl)-3-[(E)-3-furylmethyleneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3-chlorophenyl)-3-[(E)-3-furanylmethylideneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-(3-chlorophenyl)-3-[(E)-furan-3-ylmethylideneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-chlorophenyl)-[3-[(E)-3-furfurylideneamino]-2H-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C16H11ClN6O MolecularWeight: 338.75114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)N=CC4=COC=C4

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=NNC(=C32)/N=C/C4=COC=C4

InChI

InChI=1S/C16H11ClN6O/c17-11-2-1-3-12(6-11)21-14-13-15(18-7-10-4-5-24-8-10)22-23-16(13)20-9-19-14/h1-9H,(H2,19,20,21,22,23)/b18-7+