Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]acetohydrazide
Catalog ID
STK543582
SMILES COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/C=C/c1ccccc1[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 C23H24N6O5S MW 496.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O5S/c1-4-28-22(17-11-12-19(33-2)20(14-17)34-3)26-27-23(28)35-15-21(30)25-24-13-7-9-16-8-5-6-10-18(16)29(31)32/h5-14H,4,15H2,1-3H3,(H,25,30)/b9-7+,24-13+InChIKey
HBALBKBPVPSALT-APLRVFJTSA-NSynonyms
488095-07-4(E)2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)thio)N((E)3(2nitrophenyl)allylidene)acetohydrazide
2((5(34DIMETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((E)((E)3(2NITROPHENYL)PROP2ENYLIDENE)AMINO)ACETAMIDE
2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N((1E2E)3(2nitrophenyl)prop2en1ylidene)acetohydrazide
488095074
CCN1C(=NN=C1SCC(=O)NN=CC=CC2=CC=CC=C2(N+)(=O)(O))C3=CC(=C(C=C3)OC)OC
COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)NN=CC=Cc1ccccc1(N+)(=O)(O)
InChI=1SC23H24N6O5Sc142822(17111219(332)20(1417)343)262723(28)351521(30)25241379168561018(16)29(31)32h514H415H213H3(H2530)b97+2413+
MFCD03288206
ZINC000002326352
ZINC33583532
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