Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3-phenoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK542648
SMILES COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C\c1cccc(c1)Oc1ccccc1
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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/c1-4-32-26(20-13-14-23(34-2)24(16-20)35-3)30-31-27(32)37-18-25(33)29-28-17-19-9-8-12-22(15-19)36-21-10-6-5-7-11-21/h5-17H,4,18H2,1-3H3,(H,29,33)/b28-17-InChIKey
KSJJNFSHECSFDT-QRQIAZFYSA-NSynonyms
497942-10-6(Z)2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)thio)N(3phenoxybenzylidene)acetohydrazide
2((5(34DIMETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((Z)(3PHENOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(34dimethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N((Z)(3phenoxyphenyl)methylidene)acetohydrazide
497942106
CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)NN=Cc1cccc(c1)Oc1ccccc1
InChI=1SC27H27N5O4Sc143226(20131423(342)24(1620)353)303127(32)371825(33)29281719981222(1519)3621106571121h517H418H213H3(H2933)b2817
MFCD03301363
ZINC000031885720
ZINC01246400
ZINC1246400
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