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

Systemtic Name: 5-[cyclohexylmethyl-[2-[4-(2-methylpropanoyl)piperazin-1-yl]ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[cyclohexylmethyl-[2-[4-(2-methylpropanoyl)piperazin-1-yl]ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[cyclohexylmethyl-[2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[cyclohexylmethyl-[2-[4-(2-methylpropanoyl)piperazin-1-yl]ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[cyclohexylmethyl-[2-(4-isobutyrylpiperazino)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C26H43N7O2 MolecularWeight: 485.66532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CCN3CCN(CC3)C(=O)C(C)C)CC4CCCCC4)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CCN3CCN(CC3)C(=O)C(C)C)CC4CCCCC4)C

InChI

InChI=1S/C26H43N7O2/c1-5-9-21-22-23(30(4)29-21)24(34)28-26(27-22)33(18-20-10-7-6-8-11-20)17-14-31-12-15-32(16-13-31)25(35)19(2)3/h19-20H,5-18H2,1-4H3,(H,27,28,34)