Vitas-M small molecule compound
3-[(4-fluorophenoxy)methyl]-6-[(E)-2-(4-nitrophenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK242392
SMILES Fc1ccc(cc1)OCc1nnc2n1nc(s2)/C=C/c1ccc(cc1)[N+](=O)[O-]
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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 C18H12FN5O3S MW 397.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12FN5O3S/c19-13-4-8-15(9-5-13)27-11-16-20-21-18-23(16)22-17(28-18)10-3-12-1-6-14(7-2-12)24(25)26/h1-10H,11H2/b10-3+InChIKey
VRVFYSKIYYAZIP-XCVCLJGOSA-NSynonyms
3((4fluorophenoxy)methyl)6((E)2(4nitrophenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
C1=CC(=CC=C1C=CC2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)F)(N+)(=O)(O)
Fc1ccc(cc1)OCc1nnc2n1nc(s2)C=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H12FN5O3Sc19134815(9513)27111620211823(16)2217(2818)103121614(7212)24(25)26h110H11H2b103+
MFCD08684130
ZINC000008393472
ZINC08393472
ZINC8393472
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