Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-ethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK100629
SMILES CCOc1ccccc1/C=N/NC(=O)CSc1nnc(n1CC)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 C25H31N5O2S MW 465.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O2S/c1-6-30-23(18-12-14-20(15-13-18)25(3,4)5)28-29-24(30)33-17-22(31)27-26-16-19-10-8-9-11-21(19)32-7-2/h8-16H,6-7,17H2,1-5H3,(H,27,31)/b26-16+InChIKey
XBPBPNLOPBHJNF-WGOQTCKBSA-NSynonyms
487023-59-6(E)2((5(4(tertbutyl)phenyl)4ethyl4H124triazol3yl)thio)N(2ethoxybenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((E)(2ETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N((E)(2ETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
487023596
CCN1C(=NN=C1SCC(=O)NN=CC2=CC=CC=C2OCC)C3=CC=C(C=C3)C(C)(C)C
CCOc1ccccc1C=NNC(=O)CSc1nnc(n1CC)c1ccc(cc1)C(C)(C)C
InChI=1SC25H31N5O2Sc163023(18121420(151318)25(34)5)282924(30)331722(31)2726161910891121(19)3272h816H6717H215H3(H2731)b2616+
MFCD03286554
ZINC000002321135
ZINC33360519
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