Vitas-M small molecule compound
2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]acetohydrazide
Catalog ID
STK059508
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/C(=C/c1ccccc1)/C
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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-20(17-21-9-5-3-6-10-21)18-28-29-25(33)19-35-27-31-30-26(22-13-15-24(34-2)16-14-22)32(27)23-11-7-4-8-12-23/h3-18H,19H2,1-2H3,(H,29,33)/b20-17+,28-18+InChIKey
ZMWOASKYCLQGEY-QQLOIZATSA-NSynonyms
314289-09-3(E)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)thio)N((E)2methyl3phenylallylidene)acetohydrazide
2((5(4METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)((E)2METHYL3PHENYLPROP2ENYLIDENE)AMINO)ACETAMIDE
2((5(4METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E2E)2METHYL3PHENYLPROP2EN1YLIDENE)ACETOHYDRAZIDE
314289093
CC(=CC1=CC=CC=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)NN=CC(=Cc1ccccc1)C
InChI=1SC27H25N5O2Sc120(172195361021)18282925(33)193527313026(22131524(342)161422)32(27)23117481223h318H19H212H3(H2933)b2017+2818+
MFCD02669840
STK059508
ZINC000004464489
ZINC33794905
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