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

Systemtic Name: 5-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Openeye Name: 5-(2-methoxy-5-morpholinosulfonyl-phenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione CAS Name: 5-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione IUPAC Name: 5-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Traditional Name: 5-(2-methoxy-5-morpholinosulfonyl-phenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Formula: C20H25N5O4S2 MolecularWeight: 463.5736

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=S)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC)C

InChI

InChI=1S/C20H25N5O4S2/c1-4-5-15-17-18(24(2)23-15)20(30)22-19(21-17)14-12-13(6-7-16(14)28-3)31(26,27)25-8-10-29-11-9-25/h6-7,12H,4-5,8-11H2,1-3H3,(H,21,22,30)