4-[2-(4-chlorophenyl)pyrrolidin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[2-(4-chlorophenyl)pyrrolidin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[2-(4-chlorophenyl)pyrrolidin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[2-(4-chlorophenyl)-1-pyrrolidinyl]-1-methylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[2-(4-chlorophenyl)pyrrolidin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[2-(4-chlorophenyl)pyrrolidino]-1-methyl-pyrazolo[3,4-d]pyrimidine Formula: C16H16ClN5 MolecularWeight: 313.78474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCCC3C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCCC3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C16H16ClN5/c1-21-15-13(9-20-21)16(19-10-18-15)22-8-2-3-14(22)11-4-6-12(17)7-5-11/h4-7,9-10,14H,2-3,8H2,1H3