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Vitas-M small molecule compound

1-methyl-5-[(4-methylphenyl)sulfanyl]-3-nitro-1H-1,2,4-triazole

Catalog ID
STK877877
SMILES Cc1ccc(cc1)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 C10H10N4O2S MW 250.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N4O2S/c1-7-3-5-8(6-4-7)17-10-11-9(14(15)16)12-13(10)2/h3-6H,1-2H3
InChIKey
WPIDHHROANJLHF-UHFFFAOYSA-N
Synonyms
692275-86-8
1methyl3nitro5(ptolylthio)1H124triazole
1methyl5((4methylphenyl)sulfanyl)3nitro1H124triazole
1METHYL5((4METHYLPHENYL)THIO)3NITRO1H124TRIAZOLE
1METHYL5(4METHYLPHENYL)SULFANYL3NITRO124TRIAZOLE
692275868
CC1=CC=C(C=C1)SC2=NC(=NN2C)(N+)(=O)(O)
Cc1ccc(cc1)Sc1nc(nn1C)(N+)(=O)(O)
InChI=1SC10H10N4O2Sc17358(647)1710119(14(15)16)1213(10)2h36H12H3
MFCD03666515
ZINC000000465379
ZINC00465379
ZINC465379

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Available files

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

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