Vitas-M small molecule compound
3-[(3,4-dichlorobenzyl)sulfanyl]-5-[3-(4-methoxy-3-methylphenyl)propyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK186605
SMILES COc1ccc(cc1C)CCCc1nnc(n1C)SCc1ccc(c(c1)Cl)Cl
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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 C21H23Cl2N3OS MW 436.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23Cl2N3OS/c1-14-11-15(8-10-19(14)27-3)5-4-6-20-24-25-21(26(20)2)28-13-16-7-9-17(22)18(23)12-16/h7-12H,4-6,13H2,1-3H3InChIKey
CCSKTXNTKFCBGJ-UHFFFAOYSA-NSynonyms
3((34DICHLOROBENZYL)SULFANYL)5(3(4METHOXY3METHYLPHENYL)PROPYL)4METHYL4H124TRIAZOLE
3((34dichlorophenyl)methylsulfanyl)5(3(4methoxy3methylphenyl)propyl)4methyl124triazole
3(34DICHLOROBENZYLSULFANYL)5(3(4METHOXY3METHYLPHENYL)PROPYL)4METHYL4H(124)TRIAZOLE
CC1=C(C=CC(=C1)CCCC2=NN=C(N2C)SCC3=CC(=C(C=C3)Cl)Cl)OC
InChI=1SC21H23Cl2N3OSc1141115(81019(14)273)54620242521(26(20)2)2813167917(22)18(23)1216h712H4613H213H3
MFCD04388129
ZINC000009261113
ZINC09261113
ZINC9261113
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