Vitas-M small molecule compound

ethyl 4-({[5-(4-fluorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-methyl-1,2-oxazole-3-carboxylate

Catalog ID
STL175839
SMILES CCOC(=O)c1noc(c1CSc1nnc(n1C)c1ccc(cc1)F)C

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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 C17H17FN4O3S MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN4O3S/c1-4-24-16(23)14-13(10(2)25-21-14)9-26-17-20-19-15(22(17)3)11-5-7-12(18)8-6-11/h5-8H,4,9H2,1-3H3
InChIKey
RUGQQJCHCWPEMM-UHFFFAOYSA-N
Synonyms
931980-07-3
931980073
CCOC(=O)C1=NOC(=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)F)C
ethyl4(((5(4fluorophenyl)4methyl4H124triazol3yl)sulfanyl)methyl)5methyl12oxazole3carboxylate
ethyl4((5(4fluorophenyl)4methyl124triazol3yl)sulfanylmethyl)5methyl12oxazole3carboxylate
InChI=1SC17H17FN4O3Sc142416(23)1413(10(2)252114)92617201915(22(17)3)115712(18)8611h58H49H213H3
MFCD08554824
ZINC000013640981
ZINC13640981

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.