Vitas-M small molecule compound
1-(furan-2-ylmethyl)-7,7-dimethyl-2-(thiophen-2-yl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Catalog ID
STK691148
SMILES O=C1CC(C)(C)CC2=C1C(N=C(N2Cc1ccco1)c1cccs1)(C(F)(F)F)C(F)(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 C21H18F6N2O2S MW 476.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F6N2O2S/c1-18(2)9-13-16(14(30)10-18)19(20(22,23)24,21(25,26)27)28-17(15-6-4-8-32-15)29(13)11-12-5-3-7-31-12/h3-8H,9-11H2,1-2H3InChIKey
NQLYTWUFLSLGMS-UHFFFAOYSA-NSynonyms
1(furan2ylmethyl)77dimethyl2(thiophen2yl)44bis(trifluoromethyl)4678tetrahydroquinazolin5(1H)one
1(furan2ylmethyl)77dimethyl2thiophen2yl44bis(trifluoromethyl)68dihydroquinazolin5one
CC1(CC2=C(C(=O)C1)C(N=C(N2CC3=CC=CO3)C4=CC=CS4)(C(F)(F)F)C(F)(F)F)C
InChI=1SC21H18F6N2O2Sc118(2)91316(14(30)1018)19(20(2223)2421(2526)27)2817(156483215)29(13)11125373112h38H911H212H3
MFCD09064169
ZINC000012402219
ZINC12402219
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