Vitas-M small molecule compound
2-({5-[(3-chlorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}methyl)-5-(3,4-dimethoxyphenyl)-2H-tetrazole
Catalog ID
STK744039
SMILES CCn1c(nnc1SCc1cccc(c1)Cl)Cn1nnc(n1)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 C21H22ClN7O2S MW 471.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN7O2S/c1-4-28-19(23-25-21(28)32-13-14-6-5-7-16(22)10-14)12-29-26-20(24-27-29)15-8-9-17(30-2)18(11-15)31-3/h5-11H,4,12-13H2,1-3H3InChIKey
UKXNLRHDOBBCDC-UHFFFAOYSA-NSynonyms
903856-78-02((5((3chlorobenzyl)sulfanyl)4ethyl4H124triazol3yl)methyl)5(34dimethoxyphenyl)2Htetrazole
2((5((3chlorobenzyl)thio)4ethyl4H124triazol3yl)methyl)5(34dimethoxyphenyl)2Htetrazole
2((5((3chlorophenyl)methylsulfanyl)4ethyl124triazol3yl)methyl)5(34dimethoxyphenyl)tetrazole
903856780
CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CN3N=C(N=N3)C4=CC(=C(C=C4)OC)OC
InChI=1SC21H22ClN7O2Sc142819(232521(28)32131465716(22)1014)12292620(242729)158917(302)18(1115)313h511H41213H213H3
MFCD08291132
ZINC000012413695
ZINC12413695
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