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

Systemtic Name: 1-methyl-5-[2-(3-methylbutoxy)-5-morpholin-4-ylsulfonyl-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Openeye Name: 5-(2-isopentyloxy-5-morpholinosulfonyl-phenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione CAS Name: 1-methyl-5-[2-(3-methylbutoxy)-5-(4-morpholinylsulfonyl)phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione IUPAC Name: 1-methyl-5-[2-(3-methylbutoxy)-5-morpholin-4-ylsulfonylphenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Traditional Name: 5-(2-isoamoxy-5-morpholinosulfonyl-phenyl)-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione Formula: C24H33N5O4S2 MolecularWeight: 519.67992

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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)OCCC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H33N5O4S2/c1-5-6-19-21-22(28(4)27-19)24(34)26-23(25-21)18-15-17(7-8-20(18)33-12-9-16(2)3)35(30,31)29-10-13-32-14-11-29/h7-8,15-16H,5-6,9-14H2,1-4H3,(H,25,26,34)