Vitas-M small molecule compound
1-(pyrrolidin-1-yl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]ethanone
Catalog ID
STL430052
SMILES O=C(N1CCCC1)Cn1c2cc3OCCOc3cc2nc1C(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 C16H16F3N3O3 MW 355.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F3N3O3/c17-16(18,19)15-20-10-7-12-13(25-6-5-24-12)8-11(10)22(15)9-14(23)21-3-1-2-4-21/h7-8H,1-6,9H2InChIKey
VGXAEANSMKJZFG-UHFFFAOYSA-NSynonyms
1(pyrrolidin1yl)2(2(trifluoromethyl)67dihydro1H(14)dioxino(23f)benzimidazol1yl)ethanone
1pyrrolidin1yl2(2(trifluoromethyl)67dihydro(14)dioxino(23f)benzimidazol3yl)ethanone
C1CCN(C1)C(=O)CN2C3=CC4=C(C=C3N=C2C(F)(F)F)OCCO4
InChI=1SC16H16F3N3O3c1716(1819)15201071213(25652412)811(10)22(15)914(23)21312421h78H169H2
MFCD27594872
ZINC000064814409
ZINC64814409
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