Vitas-M small molecule compound

2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK102364
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2c(OC)cc(cc2OC)OC)nnc1c1ccccc1

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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/c1-5-38-21-13-11-20(12-14-21)33-27(19-9-7-6-8-10-19)31-32-28(33)39-18-26(34)30-29-17-23-24(36-3)15-22(35-2)16-25(23)37-4/h6-17H,5,18H2,1-4H3,(H,30,34)/b29-17+
InChIKey
DVGKXCPRHLVRHA-STBIYBPSSA-N
Synonyms
497951-15-2
(E)2((4(4ethoxyphenyl)5phenyl4H124triazol3yl)thio)N(246trimethoxybenzylidene)acetohydrazide
2((4(4ETHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)N((E)(246TRIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4ETHOXYPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(246TRIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
497951152
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=C(C=C(C=C3OC)OC)OC)C4=CC=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2c(OC)cc(cc2OC)OC)nnc1c1ccccc1
InChI=1SC28H29N5O5Sc153821131120(121421)3327(1997681019)313228(33)391826(34)3029172324(363)1522(352)1625(23)374h617H518H214H3(H3034)b2917+
MFCD03220327
ZINC000100691602
ZINC101505512

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Available files

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