Vitas-M small molecule compound
4-methoxy-3-nitro-N-[3-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Catalog ID
STK299388
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cccc(c1)c1nn2c(s1)nnc2
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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 C17H12N6O4S MW 396.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N6O4S/c1-27-14-6-5-10(8-13(14)23(25)26)15(24)19-12-4-2-3-11(7-12)16-21-22-9-18-20-17(22)28-16/h2-9H,1H3,(H,19,24)InChIKey
DRDMHFCRSNVELP-UHFFFAOYSA-NSynonyms
4methoxy3nitroN(3((124)triazolo(34b)(134)thiadiazol6yl)phenyl)benzamide
COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN4C=NN=C4S3)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Nc1cccc(c1)c1nn2c(s1)nnc2
InChI=1SC17H12N6O4Sc127146510(813(14)23(25)26)15(24)191242311(712)1621229182017(22)2816h29H1H3(H1924)
MFCD07628866
ZINC000013957470
ZINC13957470
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