Vitas-M small molecule compound

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

Catalog ID
STK101493
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C\c1cccc(c1)OCc1ccccc1

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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 C35H35N5O2S MW 589.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H35N5O2S/c1-25-13-19-30(20-14-25)40-33(28-15-17-29(18-16-28)35(2,3)4)38-39-34(40)43-24-32(41)37-36-22-27-11-8-12-31(21-27)42-23-26-9-6-5-7-10-26/h5-22H,23-24H2,1-4H3,(H,37,41)/b36-22-
InChIKey
OKLBGRUXBKIMEU-ICUTVXMZSA-N
Synonyms

(E)N(3(benzyloxy)benzylidene)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)acetohydrazide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)(3PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=CC=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)C(C)(C)C
InChI=1SC35H35N5O2Sc125131930(201425)4033(28151729(181628)35(23)4)383934(40)432432(41)373622271181231(2127)42232696571026h522H2324H214H3(H3741)b3622
MFCD03219985
N((1Z)2(3(PHENYLMETHOXY)PHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((Z)(3(BENZYLOXY)PHENYL)METHYLIDENE)2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)NN=Cc1cccc(c1)OCc1ccccc1
ZINC000100852143
ZINC01879895
ZINC1879895

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Available files

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