Vitas-M small molecule compound

2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxy-2,5-dimethylphenyl)ethanone

Catalog ID
STK231112
SMILES COc1cc(C)c(cc1C)C(=O)CSc1nnc(n1C)c1ccco1

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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 C18H19N3O3S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O3S/c1-11-9-16(23-4)12(2)8-13(11)14(22)10-25-18-20-19-17(21(18)3)15-6-5-7-24-15/h5-9H,10H2,1-4H3
InChIKey
AEIRBRVGMSOGNB-UHFFFAOYSA-N
Synonyms

2((5(FURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)1(4METHOXY25DIMETHYLPHENYL)ETHANONE
2((5(furan2yl)4methyl4H124triazol3yl)sulfanyl)1(4methoxy25dimethylphenyl)ethanone
CC1=CC(=C(C=C1C(=O)CSC2=NN=C(N2C)C3=CC=CO3)C)OC
InChI=1SC18H19N3O3Sc111916(234)12(2)813(11)14(22)102518201917(21(18)3)156572415h59H10H214H3
MFCD07791904
ZINC000004736458
ZINC04736458
ZINC4736458

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Available files

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