5-[5-(3,5-dimethylpiperazin-1-yl)sulfonyl-2-ethoxy-phenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione

Systemtic Name: 5-[5-(3,5-dimethylpiperazin-1-yl)sulfonyl-2-ethoxy-phenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Openeye Name: 5-[5-(3,5-dimethylpiperazin-1-yl)sulfonyl-2-ethoxy-phenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione CAS Name: 5-[5-[(3,5-dimethyl-1-piperazinyl)sulfonyl]-2-ethoxyphenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione IUPAC Name: 5-[5-(3,5-dimethylpiperazin-1-yl)sulfonyl-2-ethoxyphenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Traditional Name: 5-[5-(3,5-dimethylpiperazino)sulfonyl-2-ethoxy-phenyl]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Formula: C24H34N6O3S2 MolecularWeight: 518.69516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CC(NC(C4)C)C)OCC)CC

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CC(NC(C4)C)C)OCC)CC

InChI

InChI=1S/C24H34N6O3S2/c1-6-9-19-21-22(30(7-2)28-19)24(34)27-23(26-21)18-12-17(10-11-20(18)33-8-3)35(31,32)29-13-15(4)25-16(5)14-29/h10-12,15-16,25H,6-9,13-14H2,1-5H3,(H,26,27,34)