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

Systemtic Name: 1-methyl-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-(2-methylpropoxy)phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Openeye Name: 5-[2-isobutoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione CAS Name: 1-methyl-5-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-(2-methylpropoxy)phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione IUPAC Name: 1-methyl-5-[5-(4-methylpiperazin-1-yl)sulfonyl-2-(2-methylpropoxy)phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Traditional Name: 5-[2-isobutoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-1-methyl-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)N4CCN(CC4)C)OCC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H34N6O3S2/c1-6-7-19-21-22(29(5)27-19)24(34)26-23(25-21)18-14-17(8-9-20(18)33-15-16(2)3)35(31,32)30-12-10-28(4)11-13-30/h8-9,14,16H,6-7,10-13,15H2,1-5H3,(H,25,26,34)