Vitas-M small molecule compound

2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-5-(4-nitrophenyl)-1,3,4-oxadiazole

Catalog ID
STK129349
SMILES Cc1nnc(s1)SCc1nnc(o1)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 C12H9N5O3S2 MW 335.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N5O3S2/c1-7-13-16-12(22-7)21-6-10-14-15-11(20-10)8-2-4-9(5-3-8)17(18)19/h2-5H,6H2,1H3
InChIKey
PNBSXDZOYVUAIJ-UHFFFAOYSA-N
Synonyms

2(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)5(4NITROPHENYL)134OXADIAZOLE
2((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)5(4NITROPHENYL)134OXADIAZOLE
5((5METHYL134THIADIAZOLE2YL)THIOMETHYL)2(4NITROPHENYL)134OXADIAZOLE
CC1=NN=C(S1)SCC2=NN=C(O2)C3=CC=C(C=C3)(N+)(=O)(O)
Cc1nnc(s1)SCc1nnc(o1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC12H9N5O3S2c17131612(227)21610141511(2010)8249(538)17(18)19h25H6H21H3
MFCD07555198
ZINC000004700639
ZINC04700639
ZINC4700639

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Available files

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