Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]acetohydrazide
Catalog ID
STK004626
SMILES COc1ccc(cc1)/C(=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(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 C29H31N5O2S MW 513.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O2S/c1-20(21-13-17-25(36-5)18-14-21)30-31-26(35)19-37-28-33-32-27(34(28)24-9-7-6-8-10-24)22-11-15-23(16-12-22)29(2,3)4/h6-18H,19H2,1-5H3,(H,31,35)/b30-20+InChIKey
HOBPKWSWQZYDMF-TWKHWXDSSA-NSynonyms
303107-30-4(Z)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(1(4methoxyphenyl)ethylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)1(4METHOXYPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E)1(4METHOXYPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
303107304
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)C
InChI=1SC29H31N5O2Sc120(21131725(365)181421)303126(35)193728333227(34(28)2497681024)22111523(161222)29(23)4h618H19H215H3(H3135)b3020+
MFCD02675638
STK004626
ZINC000008916671
ZINC13553105
Check stock
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Check stock on Vitas-MAvailable files
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