Vitas-M small molecule compound

4-{[5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-7-nitro-2,1,3-benzoxadiazole

Catalog ID
STK243398
SMILES COc1ccc(cc1)c1nnc([nH]1)Sc1ccc(c2c1non2)[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 C15H10N6O4S MW 370.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N6O4S/c1-24-9-4-2-8(3-5-9)14-16-15(18-17-14)26-11-7-6-10(21(22)23)12-13(11)20-25-19-12/h2-7H,1H3,(H,16,17,18)
InChIKey
PCWFBYZSVPOWJD-UHFFFAOYSA-N
Synonyms

4((5(4methoxyphenyl)1H124triazol3yl)sulfanyl)7nitro213benzoxadiazole
4((5(4methoxyphenyl)4H124triazol3yl)sulfanyl)7nitro213benzoxadiazole
COC1=CC=C(C=C1)C2=NC(=NN2)SC3=CC=C(C4=NON=C34)(N+)(=O)(O)
COc1ccc(cc1)c1nnc((nH)1)Sc1ccc(c2c1non2)(N+)(=O)(O)
InChI=1SC15H10N6O4Sc1249428(359)141615(181714)26117610(21(22)23)1213(11)20251912h27H1H3(H161718)
MFCD08575602
ZINC000009227767
ZINC9227767

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Available files

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