Vitas-M small molecule compound
1-(4-bromobenzyl)-5-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-3-nitro-1H-1,2,4-triazole
Catalog ID
STK361527
SMILES Brc1ccc(cc1)Cn1nc(nc1Sc1oc(c(n1)C)C)[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 C14H12BrN5O3S MW 410.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrN5O3S/c1-8-9(2)23-14(16-8)24-13-17-12(20(21)22)18-19(13)7-10-3-5-11(15)6-4-10/h3-6H,7H2,1-2H3InChIKey
MCSAMUXGAZUVEM-UHFFFAOYSA-NSynonyms
1040709-78-11(4bromobenzyl)5((45dimethyl13oxazol2yl)sulfanyl)3nitro1H124triazole
1040709781
2((1(4bromobenzyl)3nitro1H124triazol5yl)thio)45dimethyloxazole
2((2((4bromophenyl)methyl)5nitro124triazol3yl)sulfanyl)45dimethyl13oxazole
Brc1ccc(cc1)Cn1nc(nc1Sc1oc(c(n1)C)C)(N+)(=O)(O)
CC1=C(OC(=N1)SC2=NC(=NN2CC3=CC=C(C=C3)Br)(N+)(=O)(O))C
InChI=1SC14H12BrN5O3Sc189(2)2314(168)24131712(20(21)22)1819(13)7103511(15)6410h36H7H212H3
MFCD11696055
ZINC000019828063
ZINC19828063
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