Vitas-M small molecule compound
diethyl 2-{4-[(difluoromethyl)sulfanyl]phenyl}-1,3-dimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Catalog ID
STK317857
SMILES CCOC(=O)c1cc2c(C)n(c(c2cc(c1=O)C(=O)OCC)C)c1ccc(cc1)SC(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H23F2NO5S MW 475.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23F2NO5S/c1-5-31-22(29)19-11-17-13(3)27(15-7-9-16(10-8-15)33-24(25)26)14(4)18(17)12-20(21(19)28)23(30)32-6-2/h7-12,24H,5-6H2,1-4H3InChIKey
RCNIUZFOUOOYGP-UHFFFAOYSA-NSynonyms
327060-72-0327060720
CCOC(=O)C1=CC2=C(N(C(=C2C=C(C1=O)C(=O)OCC)C)C3=CC=C(C=C3)SC(F)F)C
diethyl2(4((difluoromethyl)sulfanyl)phenyl)13dimethyl6oxo26dihydrocyclohepta(c)pyrrole57dicarboxylate
DIETHYL2(4((DIFLUOROMETHYL)THIO)PHENYL)13DIMETHYL6OXO26DIHYDROCYCLOHEPTA(C)PYRROLE57DICARBOXYLATE
DIETHYL2(4(DIFLUOROMETHYLSULFANYL)PHENYL)13DIMETHYL6OXOCYCLOHEPTA(C)PYRROLE57DICARBOXYLATE
ETHYL2(4(DIFLUOROMETHYLTHIO)PHENYL)7(ETHOXYCARBONYL)13DIMETHYL6OXOCYCLOHEPTA(43C)PYRROLE5CARBOXYLATE
InChI=1SC24H23F2NO5Sc153122(29)19111713(3)27(157916(10815)3324(25)26)14(4)18(17)1220(21(19)28)23(30)3262h71224H56H214H3
MFCD03448856
ZINC000009445793
ZINC09445793
ZINC9445793
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