Vitas-M small molecule compound

2-methoxy-N-[(4-methyl-5-{[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide

Catalog ID
STK245784
SMILES COc1ccccc1C(=O)NCc1nnc(n1C)SCc1nnc(o1)c1ccccc1

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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 C21H20N6O3S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S/c1-27-17(12-22-19(28)15-10-6-7-11-16(15)29-2)23-26-21(27)31-13-18-24-25-20(30-18)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3,(H,22,28)
InChIKey
GNRLDPGGRWJQIF-UHFFFAOYSA-N
Synonyms

2METHOXY(4METHYL5(5PHENYL(134)OXADIAZOL2YLMETHYLSULFANYL)(124)TRIAZOL3YLMETHYLBENZA
2METHOXYN((4METHYL5(((5PHENYL134OXADIAZOL2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
2methoxyN((4methyl5((5phenyl134oxadiazol2yl)methylsulfanyl)124triazol3yl)methyl)benzamide
CN1C(=NN=C1SCC2=NN=C(O2)C3=CC=CC=C3)CNC(=O)C4=CC=CC=C4OC
InChI=1SC21H20N6O3Sc12717(122219(28)1510671116(15)292)232621(27)311318242520(3018)148435914h311H1213H212H3(H2228)
MFCD08670503
ZINC000009328100
ZINC09328100
ZINC9328100

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Available files

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