Vitas-M small molecule compound

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

Catalog ID
STK022428
SMILES CCOc1ccc(cc1OC)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(c(c1)OC)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 C28H29N5O5S MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O5S/c1-5-38-23-13-11-19(15-24(23)36-3)17-29-30-26(34)18-39-28-32-31-27(33(28)21-9-7-6-8-10-21)20-12-14-22(35-2)25(16-20)37-4/h6-17H,5,18H2,1-4H3,(H,30,34)/b29-17+
InChIKey
AUSQJBPQJKBRII-STBIYBPSSA-N
Synonyms

(Z)2((5(34dimethoxyphenyl)4phenyl4H124triazol3yl)thio)N(4ethoxy3methoxybenzylidene)acetohydrazide
2((5(34dimethoxyphenyl)4phenyl124triazol3yl)sulfanyl)N((E)(4ethoxy3methoxyphenyl)methylideneamino)acetamide
2((5(34DIMETHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(4ETHOXY3METHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
CCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)OC
CCOc1ccc(cc1OC)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(c(c1)OC)OC
InChI=1SC28H29N5O5Sc153823131119(1524(23)363)17293026(34)183928323127(33(28)2197681021)20121422(352)25(1620)374h617H518H214H3(H3034)b2917+
MFCD02076789
N((1E)2(4ETHOXY3METHOXYPHENYL)1AZAVINYL)2(5(34DIMETHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK022428
ZINC000006090190
ZINC100885610

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Available files

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