Vitas-M small molecule compound
5-(2,6-dichlorobenzyl)-4-(2-methoxyethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448412
SMILES COCCn1c(S)nnc1Cc1c(Cl)cccc1Cl
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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 C12H13Cl2N3OS MW 318.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13Cl2N3OS/c1-18-6-5-17-11(15-16-12(17)19)7-8-9(13)3-2-4-10(8)14/h2-4H,5-7H2,1H3,(H,16,19)InChIKey
OIPBGMPZLXJTCG-UHFFFAOYSA-NSynonyms
3((26dichlorophenyl)methyl)4(2methoxyethyl)1H124triazole5thione
5((26DICHLOROPHENYL)METHYL)4(2METHOXYETHYL)124TRIAZOLE3THIOL
5(26dichlorobenzyl)4(2methoxyethyl)4H124triazole3thiol
COCCN1C(=NNC1=S)CC2=C(C=CC=C2Cl)Cl
InChI=1SC12H13Cl2N3OSc118651711(151612(17)19)789(13)32410(8)14h24H57H21H3(H1619)
MFCD04140944
ZINC000017054492
ZINC17054492
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