Vitas-M small molecule compound

N'-[(E)-(3-methylphenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL362665
SMILES COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1cccc(c1)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 C27H27N5O4S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4S/c1-18-9-8-10-19(13-18)16-28-29-24(33)17-37-27-31-30-26(32(27)21-11-6-5-7-12-21)20-14-22(34-2)25(36-4)23(15-20)35-3/h5-16H,17H2,1-4H3,(H,29,33)/b28-16+
InChIKey
ZEZADUMREUQUOR-LQKURTRISA-N
Synonyms
315184-60-2
(E)N(3methylbenzylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)thio)acetohydrazide
315184602
CC1=CC=CC(=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC
COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cccc(c1)C
InChI=1SC27H27N5O4Sc118981019(1318)16282924(33)173727313026(32(27)21116571221)201422(342)25(364)23(1520)353h516H17H214H3(H2933)b2816+
MFCD02075205
N((1E)2(3METHYLPHENYL)1AZAVINYL)2(4PHENYL5(345TRIMETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(3methylphenyl)methylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(3METHYLPHENYL)METHYLIDENEAMINO)2((4PHENYL5(345TRIMETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001477485
ZINC33341967

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Available files

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