N-butyl-1-(4-chlorophenyl)-6-methoxy-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-butyl-1-(4-chlorophenyl)-6-methoxy-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-butyl-1-(4-chlorophenyl)-6-methoxy-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-butyl-1-(4-chlorophenyl)-6-methoxy-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-butyl-1-(4-chlorophenyl)-6-methoxypyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: butyl-[1-(4-chlorophenyl)-6-methoxy-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC2=C1C=NN2C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCCCNC1=NC(=NC2=C1C=NN2C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C16H18ClN5O/c1-3-4-9-18-14-13-10-19-22(12-7-5-11(17)6-8-12)15(13)21-16(20-14)23-2/h5-8,10H,3-4,9H2,1-2H3,(H,18,20,21)