Vitas-M small molecule compound
2-[1-(3-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-4,5-dimethoxy-1H-isoindole-1,3(2H)-dione
Catalog ID
STL175227
SMILES COc1c(OC)ccc2c1C(=O)N(C2=O)c1ncn(n1)Cc1cccc(c1)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 C19H15FN4O4 MW 382.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15FN4O4/c1-27-14-7-6-13-15(16(14)28-2)18(26)24(17(13)25)19-21-10-23(22-19)9-11-4-3-5-12(20)8-11/h3-8,10H,9H2,1-2H3InChIKey
KSVIBKCNZWQGTA-UHFFFAOYSA-NSynonyms
938018-35-02(1((3fluorophenyl)methyl)124triazol3yl)45dimethoxyisoindole13dione
2(1(3fluorobenzyl)1H124triazol3yl)45dimethoxy1Hisoindole13(2H)dione
938018350
COC1=C(C2=C(C=C1)C(=O)N(C2=O)C3=NN(C=N3)CC4=CC(=CC=C4)F)OC
InChI=1SC19H15FN4O4c12714761315(16(14)282)18(26)24(17(13)25)19211023(2219)91143512(20)811h3810H9H212H3
MFCD08558631
ZINC000020607151
ZINC20607151
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