Vitas-M small molecule compound

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

Catalog ID
STK106567
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)N(C)C)nnc1c1ccc(cc1)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 C27H28N6O3S MW 516.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6O3S/c1-32(2)21-9-5-19(6-10-21)17-28-29-25(34)18-37-27-31-30-26(20-7-13-23(35-3)14-8-20)33(27)22-11-15-24(36-4)16-12-22/h5-17H,18H2,1-4H3,(H,29,34)/b28-17+
InChIKey
KBOZASPPGBGHLV-OGLMXYFKSA-N
Synonyms
406203-22-3
(E)2((45bis(4methoxyphenyl)4H124triazol3yl)thio)N(4(dimethylamino)benzylidene)acetohydrazide
2((45bis(4methoxyphenyl)124triazol3yl)sulfanyl)N((E)(4(dimethylamino)phenyl)methylideneamino)acetamide
2((45BIS(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4DIMETHYLAMINOPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((45BIS(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(4(DIMETHYLAMINO)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
406203223
CN(C)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)N(C)C)nnc1c1ccc(cc1)OC
InChI=1SC27H28N6O3Sc132(2)219519(61021)17282925(34)183727313026(2071323(353)14820)33(27)22111524(364)161222h517H18H214H3(H2934)b2817+
MFCD03220724
ZINC000001258803
ZINC33330558

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Available files

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