6-[(3S,4S)-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]pyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3S,4S)-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]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-[(5-methylpyrazin-2-yl)methyl]pyrrolidin-3-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3S,4S)-4-methyl-1-[(5-methyl-2-pyrazinyl)methyl]-3-pyrrolidinyl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3S,4S)-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]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-[(5-methylpyrazin-2-yl)methyl]pyrrolidin-3-yl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H25N7O MolecularWeight: 367.4481

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1C2=NC(=O)C3=CNN(C3=N2)C(C)C)CC4=NC=C(N=C4)C

Isomeric SMILES

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

InChI

InChI=1S/C19H25N7O/c1-11(2)26-18-15(7-22-26)19(27)24-17(23-18)16-10-25(8-12(16)3)9-14-6-20-13(4)5-21-14/h5-7,11-12,16,22H,8-10H2,1-4H3/t12-,16-/m1/s1