Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(4-methoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK101592
SMILES COc1ccc(cc1)/C=N\NC(=O)CSc1nnc(n1c1ccc(cc1)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 C29H31N5O2S MW 513.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O2S/c1-20-6-14-24(15-7-20)34-27(22-10-12-23(13-11-22)29(2,3)4)32-33-28(34)37-19-26(35)31-30-18-21-8-16-25(36-5)17-9-21/h6-18H,19H2,1-5H3,(H,31,35)/b30-18-
InChIKey
AFZDVEPPDFPLGA-YKQZZPSBSA-N
Synonyms

(E)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(4methoxybenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)(4METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((Z)(4METHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)OC)C4=CC=C(C=C4)C(C)(C)C
COc1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C
InChI=1SC29H31N5O2Sc12061424(15720)3427(22101223(131122)29(23)4)323328(34)371926(35)3130182181625(365)17921h618H19H215H3(H3135)b3018
MFCD03219954
N((1Z)2(4METHOXYPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000030735385
ZINC01740804
ZINC1740804

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Available files

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