3-tert-butyl-5-[cyclohexylmethyl(oxan-2-ylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-tert-butyl-5-[cyclohexylmethyl(oxan-2-ylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-tert-butyl-5-[cyclohexylmethyl(tetrahydropyran-2-ylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-tert-butyl-5-[cyclohexylmethyl(2-oxanylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-tert-butyl-5-[cyclohexylmethyl(oxan-2-ylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-tert-butyl-5-[cyclohexylmethyl(tetrahydropyran-2-ylmethyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H37N5O2 MolecularWeight: 415.57218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC4CCCCO4)C

Isomeric SMILES

CC(C)(C)C1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC4CCCCO4)C

InChI

InChI=1S/C23H37N5O2/c1-23(2,3)20-18-19(27(4)26-20)21(29)25-22(24-18)28(14-16-10-6-5-7-11-16)15-17-12-8-9-13-30-17/h16-17H,5-15H2,1-4H3,(H,24,25,29)