Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK722859
SMILES COc1cc(OC)cc(c1/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C(C)(C)C)OC
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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 C31H35N5O5S MW 589.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N5O5S/c1-31(2,3)21-10-8-20(9-11-21)29-34-35-30(36(29)22-12-14-23(38-4)15-13-22)42-19-28(37)33-32-18-25-26(40-6)16-24(39-5)17-27(25)41-7/h8-18H,19H2,1-7H3,(H,33,37)/b32-18+InChIKey
CMLZPXWNRYOQKX-KCSSXMTESA-NSynonyms
(E)2((5(4(tertbutyl)phenyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(246trimethoxybenzylidene)acetohydrazide
2((5(4tertbutylphenyl)4(4methoxyphenyl)124triazol3yl)sulfanyl)N((E)(246trimethoxyphenyl)methylideneamino)acetamide
2((5(4tertbutylphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)N((E)(246trimethoxyphenyl)methylidene)acetohydrazide
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NN=CC4=C(C=C(C=C4OC)OC)OC
COc1cc(OC)cc(c1C=NNC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccc(cc1)C(C)(C)C)OC
InChI=1SC31H35N5O5Sc131(23)2110820(91121)29343530(36(29)22121423(384)151322)421928(37)3332182526(406)1624(395)1727(25)417h818H19H217H3(H3337)b3218+
MFCD03220013
N((1E)2(246TRIMETHOXYPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000100852123
ZINC102642139
Check stock
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Check stock on Vitas-MAvailable files
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