6-[(3S,4S)-4-methyl-1-(quinolin-3-ylmethyl)pyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3S,4S)-4-methyl-1-(quinolin-3-ylmethyl)pyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-isopropyl-6-[(3S,4S)-4-methyl-1-(3-quinolylmethyl)pyrrolidin-3-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3S,4S)-4-methyl-1-(3-quinolinylmethyl)-3-pyrrolidinyl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3S,4S)-4-methyl-1-(quinolin-3-ylmethyl)pyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-isopropyl-6-[(3S,4S)-4-methyl-1-(3-quinolylmethyl)pyrrolidin-3-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H26N6O MolecularWeight: 402.49214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1C2=NC(=O)C3=CNN(C3=N2)C(C)C)CC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C[C@@H]1CN(C[C@H]1C2=NC(=O)C3=CNN(C3=N2)C(C)C)CC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C23H26N6O/c1-14(2)29-22-18(10-25-29)23(30)27-21(26-22)19-13-28(11-15(19)3)12-16-8-17-6-4-5-7-20(17)24-9-16/h4-10,14-15,19,25H,11-13H2,1-3H3/t15-,19-/m1/s1