Vitas-M small molecule compound
3-[(3,4-dichlorobenzyl)sulfanyl]-5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK400776
SMILES CCc1ccc(cc1)OC(c1nnc(n1C)SCc1ccc(c(c1)Cl)Cl)C
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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 C20H21Cl2N3OS MW 422.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3OS/c1-4-14-5-8-16(9-6-14)26-13(2)19-23-24-20(25(19)3)27-12-15-7-10-17(21)18(22)11-15/h5-11,13H,4,12H2,1-3H3InChIKey
SBROCGLBPNAGHT-UHFFFAOYSA-NSynonyms
1((5((34DICHLOROPHENYL)METHYLTHIO)4METHYL(124TRIAZOL3YL))ETHOXY)4ETHYLBENZENE
3((34dichlorobenzyl)sulfanyl)5(1(4ethylphenoxy)ethyl)4methyl4H124triazole
3((34DICHLOROPHENYL)METHYLSULFANYL)5(1(4ETHYLPHENOXY)ETHYL)4METHYL124TRIAZOLE
CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2C)SCC3=CC(=C(C=C3)Cl)Cl
InChI=1SC20H21Cl2N3OSc14145816(9614)2613(2)19232420(25(19)3)27121571017(21)18(22)1115h51113H412H213H3
MFCD07057491
ZINC000017092938
ZINC000017092939
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