Vitas-M small molecule compound
methyl 4-chloro-3-[({[5-(3,5-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL416242
SMILES COc1cc(OC)cc(c1)c1nnc(n1CC)SCC(=O)Nc1cc(ccc1Cl)C(=O)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 C22H23ClN4O5S MW 490.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O5S/c1-5-27-20(14-8-15(30-2)11-16(9-14)31-3)25-26-22(27)33-12-19(28)24-18-10-13(21(29)32-4)6-7-17(18)23/h6-11H,5,12H2,1-4H3,(H,24,28)InChIKey
OEUIEZWSVFREJS-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)C3=CC(=CC(=C3)OC)OC
InChI=1SC22H23ClN4O5Sc152720(14815(302)1116(914)313)252622(27)331219(28)24181013(21(29)324)6717(18)23h611H512H214H3(H2428)
methyl4chloro3((((5(35dimethoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4CHLORO3((2((5(35DIMETHOXYPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD05842118
ZINC000001068522
ZINC01068522
ZINC1068522
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