Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(2-chloro-6-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK025146
SMILES O=C(C1=C(C)NC2=C(C1c1c(F)cccc1Cl)C(=O)CC(C2)(C)C)OCC1CCCO1
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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 C24H27ClFNO4 MW 447.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClFNO4/c1-13-19(23(29)31-12-14-6-5-9-30-14)22(20-15(25)7-4-8-16(20)26)21-17(27-13)10-24(2,3)11-18(21)28/h4,7-8,14,22,27H,5-6,9-12H2,1-3H3InChIKey
PDXXJQQKWKRSFP-UHFFFAOYSA-NSynonyms
6238-38-61AZABICYCLO(222)OCTANE3METHANAMINENNDIMETHYL
6238386
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=CC=C3Cl)F)C(=O)OCC4CCCO4
InChI=1SC24H27ClFNO4c11319(23(29)3112146593014)22(2015(25)74816(20)26)2117(2713)1024(23)1118(21)28h478142227H56912H213H3
MFCD01975542
O=C(C1=C(C)NC2=C(C1c1c(F)cccc1Cl)C(=O)CC(C2)(C)C)OCC1CCCO1
oxolan2ylmethyl4(2chloro6fluorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK025146
tetrahydrofuran2ylmethyl4(2chloro6fluorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000001476183
ZINC000001476186
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