1-(3-chlorophenyl)-4-[(3S)-3-methylpiperidin-1-yl]pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(3-chlorophenyl)-4-[(3S)-3-methylpiperidin-1-yl]pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(3-chlorophenyl)-4-[(3S)-3-methyl-1-piperidyl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-(3-chlorophenyl)-4-[(3S)-3-methyl-1-piperidinyl]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(3-chlorophenyl)-4-[(3S)-3-methylpiperidin-1-yl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-(3-chlorophenyl)-4-[(3S)-3-methylpiperidino]pyrazolo[3,4-d]pyrimidine Formula: C17H18ClN5 MolecularWeight: 327.81132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl

Isomeric SMILES

C[C@H]1CCCN(C1)C2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H18ClN5/c1-12-4-3-7-22(10-12)16-15-9-21-23(17(15)20-11-19-16)14-6-2-5-13(18)8-14/h2,5-6,8-9,11-12H,3-4,7,10H2,1H3/t12-/m0/s1