5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[cyclohexylmethyl(2-methylbutyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H35N5O MolecularWeight: 373.5355

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC(C)CC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC(C)CC)C

InChI

InChI=1S/C21H35N5O/c1-5-10-17-18-19(25(4)24-17)20(27)23-21(22-18)26(13-15(3)6-2)14-16-11-8-7-9-12-16/h15-16H,5-14H2,1-4H3,(H,22,23,27)