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

Systemtic Name: 5-[cyclohexylmethyl-[2-(4-propan-2-ylsulfonylpiperazin-1-yl)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[cyclohexylmethyl-[2-(4-isopropylsulfonylpiperazin-1-yl)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[cyclohexylmethyl-[2-(4-propan-2-ylsulfonyl-1-piperazinyl)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[cyclohexylmethyl-[2-(4-propan-2-ylsulfonylpiperazin-1-yl)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[cyclohexylmethyl-[2-(4-isopropylsulfonylpiperazino)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C25H43N7O3S MolecularWeight: 521.71902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H43N7O3S/c1-5-9-21-22-23(29(4)28-21)24(33)27-25(26-22)31(18-20-10-7-6-8-11-20)15-12-30-13-16-32(17-14-30)36(34,35)19(2)3/h19-20H,5-18H2,1-4H3,(H,26,27,33)