4-Methyl-6-(6-Methyl-Benzothiazol-2-Ylcarbamoyl)-Cyclohex-3-Enecarboxylic Acid
[CAS# 436088-55-0]

Identification

• Name: 4-Methyl-6-(6-Methyl-Benzothiazol-2-Ylcarbamoyl)-Cyclohex-3-Enecarboxylic Acid
• Synonyms: (1S,6R)-4-Methyl-6-[[(6-Methyl-1,3-Benzothiazol-2-Yl)Amino]-Oxomethyl]-1-Cyclohex-3-Enecarboxylate; Zinc04976937
• Molecular Formula: C₁₇H₁₇N₂O₃S
• Molecular Weight: 329.39
• CAS Registry Number: 436088-55-0
• SMILES: [C@@H]1([C@@H](C([O-])=O)CC=C(C1)C)C(=O)NC2=NC3=C(S2)C=C(C=C3)C
• InChI: 1S/C17H18N2O3S/c1-9-3-5-11(16(21)22)12(7-9)15(20)19-17-18-13-6-4-10(2)8-14(13)23-17/h3-4,6,8,11-12H,5,7H2,1-2H3,(H,21,22)(H,18,19,20)/p-1/t11-,12+/m0/s1
• InChIKey: IVCSMRNUYHKNBU-NWDGAFQWSA-M