Vitas-M small molecule compound
4-(2,3-dibromopropyl)-3-(ethylsulfanyl)-5-(4-nitrophenyl)-4H-1,2,4-triazole
Catalog ID
STL012063
SMILES CCSc1nnc(n1CC(CBr)Br)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 C13H14Br2N4O2S MW 450.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14Br2N4O2S/c1-2-22-13-17-16-12(18(13)8-10(15)7-14)9-3-5-11(6-4-9)19(20)21/h3-6,10H,2,7-8H2,1H3InChIKey
VKDXGOCKQQKZON-UHFFFAOYSA-NSynonyms
324579-62-6324579626
4(23dibromopropyl)3(ethylsulfanyl)5(4nitrophenyl)4H124triazole
4(23DIBROMOPROPYL)3(ETHYLTHIO)5(4NITROPHENYL)4H124TRIAZOLE
4(23DIBROMOPROPYL)3ETHYLSULFANYL5(4NITROPHENYL)124TRIAZOLE
4(23DIBROMOPROPYL)3ETHYLTHIO5(4NITROPHENYL)124TRIAZOLE
CCSC1=NN=C(N1CC(CBr)Br)C2=CC=C(C=C2)(N+)(=O)(O)
CCSc1nnc(n1CC(CBr)Br)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC13H14Br2N4O2Sc122213171612(18(13)810(15)714)93511(649)19(20)21h3610H278H21H3
MFCD01794547
ZINC000001462602
ZINC000001462603
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