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

Systemtic Name: 6-[(3S,4S)-4-ethyl-1-(phenylmethyl)pyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3S,4S)-1-benzyl-4-ethyl-pyrrolidin-3-yl]-1-isopropyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3S,4S)-4-ethyl-1-(phenylmethyl)-3-pyrrolidinyl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3S,4S)-1-benzyl-4-ethylpyrrolidin-3-yl]-1-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(3S,4S)-1-benzyl-4-ethyl-pyrrolidin-3-yl]-1-isopropyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC1C2=NC(=O)C3=CNN(C3=N2)C(C)C)CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O/c1-4-16-12-25(11-15-8-6-5-7-9-15)13-18(16)19-23-20-17(21(27)24-19)10-22-26(20)14(2)3/h5-10,14,16,18,22H,4,11-13H2,1-3H3/t16-,18-/m1/s1