5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione

Systemtic Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Openeye Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione CAS Name: 5-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-methoxyphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione IUPAC Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-methoxyphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Traditional Name: 5-[5-(4-ethylpiperazino)sulfonyl-2-methoxy-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Formula: C22H30N6O3S2 MolecularWeight: 490.642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OC)C

InChI

InChI=1S/C22H30N6O3S2/c1-5-7-17-19-20(26(3)25-17)22(32)24-21(23-19)16-14-15(8-9-18(16)31-4)33(29,30)28-12-10-27(6-2)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,32)