IUPAC Name: | 4-methyl-3-nitrobenzenesulfonamide |
Description: | 4-Methyl-3-nitrobenzenesulfonamide (CAS# 6949-23-1) is an intermediate used to prepare α-keto amide inhibitors of hepatitis C virus NS3 protease. It is also used to synthesize 1,4-diazepane-3,5-dione derivs. for prevention and treatment of various diseases associated with chymase. |
Molecular Weight: | 216.21 |
Molecular Formula: | C7H8N2O4S |
Canonical SMILES: | CC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-] |
InChI: | InChI=1S/C7H8N2O4S/c1-5-2-3-6(14(8,12)13)4-7(5)9(10)11/h2-4H,1H3,(H2,8,12,13) |
InChI Key: | HVCWTENLJRUJPU-UHFFFAOYSA-N |
Boiling Point: | 399.7 ℃ at 760 mmHg |
Density: | 1.475 g/cm3 |
MDL: | MFCD00460611 |
LogP: | 2.85490 |
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Related Functional Groups
Sulfur Compounds
Ethyl ([(5-methyl-3-nitro-1H-pyrazol-1-YL)methyl]sulfinyl)acetate
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