Vitas-M small molecule compound
1-benzyl-6-phenyl-4,4-bis(trifluoromethyl)-3,4-dihydro-1,3,5-triazin-2(1H)-one
Catalog ID
STK691166
SMILES O=C1NC(N=C(N1Cc1ccccc1)c1ccccc1)(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 C18H13F6N3O MW 401.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F6N3O/c19-17(20,21)16(18(22,23)24)25-14(13-9-5-2-6-10-13)27(15(28)26-16)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,26,28)InChIKey
OHFLRQZLOAHMPZ-UHFFFAOYSA-NSynonyms
1benzyl6phenyl44bis(trifluoromethyl)34dihydro135triazin2(1H)one
3benzyl4phenyl66bis(trifluoromethyl)1H135triazin2one
C1=CC=C(C=C1)CN2C(=NC(NC2=O)(C(F)(F)F)C(F)(F)F)C3=CC=CC=C3
InChI=1SC18H13F6N3Oc1917(2021)16(18(2223)24)2514(1395261013)27(15(28)2616)11127314812h110H11H2(H2628)
MFCD06018531
ZINC000012376392
ZINC12376392
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