Sulperazone
[CAS# 92739-15-6]

Identification

• Name: Sulperazone
• Synonyms: (2S,5R)-3,3-Dimethyl-4,4,7-Trioxo-4$L^{6}-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (6R,7R)-7-[[2-[(4-Ethyl-2,3-Dioxo-Piperazine-1-Carbonyl)Amino]-2-(4-Hydroxyphenyl)Acetyl]Amino]-3-[(1-Methyltetrazol-5-Yl)Sulfanylmethyl]-8-Oxo-5-Thia-1-Azabicycl
• Molecular Formula: C₃₃H₃₈N₁₀O₁₃S₃
• Molecular Weight: 878.90
• CAS Registry Number: 92739-15-6
• SMILES: [C@H]12[S](=O)(=O)C([C@@H](N1C(=O)C2)C(=O)O)(C)C.[C@H]34SCC(=C(N3C(=O)[C@H]4NC(=O)C(NC(=O)N5C(=O)C(=O)N(CC5)CC)C6=CC=C(O)C=C6)C(=O)O)CSC7=NN=N[N]7C
• InChI: 1S/C25H27N9O8S2.C8H11NO5S/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2;1-8(2)6(7(11)12)9-4(10)3-5(9)15(8,13)14/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42
• InChIKey: WIKQLQXZUYAZQC-WYWOCYEQSA-N