Vitas-M small molecule compound

2-methyl-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1,3,4-thiadiazole

Catalog ID
STK208522
SMILES Cc1nnc(s1)Sc1nc(nn1C)[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 C6H6N6O2S2 MW 258.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H6N6O2S2/c1-3-8-9-6(15-3)16-5-7-4(12(13)14)10-11(5)2/h1-2H3
InChIKey
PBNLEVKUOHIVDA-UHFFFAOYSA-N
Synonyms
697246-04-1
2((3NITRO1METHYL1H124TRIAZOL5YL)SULFANYL)5METHYL134THIADIAZOLE
2METHYL5((1METHYL3NITRO1H124TRIAZOL5YL)SULFANYL)134THIADIAZOLE
2methyl5((1methyl3nitro1H124triazol5yl)thio)134thiadiazole
2METHYL5((2METHYL5NITRO124TRIAZOL3YL)SULFANYL)134THIADIAZOLE
2METHYL5(2METHYL5NITRO2H(124)TRIAZOL3YLSULFANYL)(134)THIADIAZOLE
697246041
CC1=NN=C(S1)SC2=NC(=NN2C)(N+)(=O)(O)
Cc1nnc(s1)Sc1nc(nn1C)(N+)(=O)(O)
InChI=1SC6H6N6O2S2c13896(153)16574(12(13)14)1011(5)2h12H3
MFCD04401874
ZINC000003655877
ZINC03655877
ZINC3655877

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Available files

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