96380-69-7 Purity
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The molecular formula of EP 092 is C23H31N3O2S.
The synonyms of EP 092 are 96384-09-7 and EP-092.
The molecular weight of EP 092 is 413.6 g/mol.
EP 092 was created on October 24, 2006.
EP 092 was last modified on December 30, 2023.
The IUPAC name of EP 092 is (Z)-7-[(1R,2R,3R,4S)-3-[(E)-C-methyl-N-(phenylcarbamothioylamino)carbonimidoyl]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid.
The InChI of EP 092 is InChI=1S/C23H31N3O2S/c1-16(25-26-23(29)24-19-9-5-4-6-10-19)22-18-14-13-17(15-18)20(22)11-7-2-3-8-12-21(27)28/h2,4-7,9-10,17-18,20,22H,3,8,11-15H2,1H3,(H,27,28)(H2,24,26,29)/b7-2-,25-16+/t17-,18+,20-,22-/m1/s1.
The InChIKey of EP 092 is JFHMOIUQQPMUFD-GNZWDLFMSA-N.
The Canonical SMILES of EP 092 is CC(=NNC(=S)NC1=CC=CC=C1)C2C3CCC(C3)C2CC=CCCCC(=O)O.
The Isomeric SMILES of EP 092 is C/C(=N\NC(=S)NC1=CC=CC=C1)/[C@@H]2[C@H]3CC[C@H](C3)[C@H]2C/C=C\CCCC(=O)O.