Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL362407
SMILES COc1c(/C=N/NC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)cccc1OC
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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 C29H31N5O3S MW 529.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O3S/c1-29(2,3)22-16-14-20(15-17-22)27-32-33-28(34(27)23-11-7-6-8-12-23)38-19-25(35)31-30-18-21-10-9-13-24(36-4)26(21)37-5/h6-18H,19H2,1-5H3,(H,31,35)/b30-18+InChIKey
LPHLTRAUNRLVAI-UXHLAJHPSA-NSynonyms
361476-72-4(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(23dimethoxybenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)(23DIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(23dimethoxyphenyl)methylidene)acetohydrazide
361476724
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=C(C(=CC=C4)OC)OC
COc1c(C=NNC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)cccc1OC
InChI=1SC29H31N5O3Sc129(23)22161420(151722)27323328(34(27)23117681223)381925(35)313018211091324(364)26(21)375h618H19H215H3(H3135)b3018+
MFCD02641873
N((1E)2(23DIMETHOXYPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002338769
ZINC33361470
Check stock
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Check stock on Vitas-MAvailable files
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