4-methoxy-3-(1-methyl-3-propyl-7-sulfanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride

Systemtic Name: 4-methoxy-3-(1-methyl-3-propyl-7-sulfanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride Openeye Name: 4-methoxy-3-(1-methyl-3-propyl-7-thioxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride CAS Name: 4-methoxy-3-(1-methyl-3-propyl-7-sulfanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride IUPAC Name: 4-methoxy-3-(1-methyl-3-propyl-7-sulfanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride Traditional Name: 4-methoxy-3-(1-methyl-3-propyl-7-thioxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonyl chloride Formula: C16H17ClN4O3S2 MolecularWeight: 412.91418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN4O3S2/c1-4-5-11-13-14(21(2)20-11)16(25)19-15(18-13)10-8-9(26(17,22)23)6-7-12(10)24-3/h6-8H,4-5H2,1-3H3,(H,18,19,25)