Vitas-M small molecule compound
N'-[(E)-(4-tert-butylphenyl)methylidene]-2-{[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK047447
SMILES COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1ccc(cc1)C(C)(C)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 C28H29N5O2S MW 499.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O2S/c1-28(2,3)22-14-10-20(11-15-22)18-29-30-25(34)19-36-27-32-31-26(21-12-16-24(35-4)17-13-21)33(27)23-8-6-5-7-9-23/h5-18H,19H2,1-4H3,(H,30,34)/b29-18+InChIKey
BQGSGCONXHTSBY-RDRPBHBLSA-NSynonyms
314288-86-3(E)N(4(tertbutyl)benzylidene)2((5(4methoxyphenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
314288863
CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1ccc(cc1)C(C)(C)C
InChI=1SC28H29N5O2Sc128(23)22141020(111522)18293025(34)193627323126(21121624(354)171321)33(27)238657923h518H19H214H3(H3034)b2918+
MFCD02669834
N((E)(4TERTBUTYLPHENYL)METHYLIDENE)2((5(4METHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)(4TERTBUTYLPHENYL)METHYLIDENEAMINO)2((5(4METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
STK047447
ZINC000002342234
ZINC33089378
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