3-tert-butyl-5-[cyclopropylmethyl-[(3-pyrazol-1-ylphenyl)methyl]amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-tert-butyl-5-[cyclopropylmethyl-[(3-pyrazol-1-ylphenyl)methyl]amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-tert-butyl-5-[cyclopropylmethyl-[(3-pyrazol-1-ylphenyl)methyl]amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-tert-butyl-5-[cyclopropylmethyl-[[3-(1-pyrazolyl)phenyl]methyl]amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-tert-butyl-5-[cyclopropylmethyl-[(3-pyrazol-1-ylphenyl)methyl]amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-tert-butyl-5-[cyclopropylmethyl-(3-pyrazol-1-ylbenzyl)amino]-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C24H29N7O MolecularWeight: 431.53336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C2=C1NC(=NC2=O)N(CC3CC3)CC4=CC(=CC=C4)N5C=CC=N5)C

Isomeric SMILES

CC(C)(C)C1=NN(C2=C1NC(=NC2=O)N(CC3CC3)CC4=CC(=CC=C4)N5C=CC=N5)C

InChI

InChI=1S/C24H29N7O/c1-24(2,3)21-19-20(29(4)28-21)22(32)27-23(26-19)30(14-16-9-10-16)15-17-7-5-8-18(13-17)31-12-6-11-25-31/h5-8,11-13,16H,9-10,14-15H2,1-4H3,(H,26,27,32)