Vitas-M small molecule compound
3-(2-bromophenyl)-6-[(4-tert-butylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK506614
SMILES Brc1ccccc1c1nnc2n1nc(s2)COc1ccc(cc1)C(C)(C)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 C20H19BrN4OS MW 443.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN4OS/c1-20(2,3)13-8-10-14(11-9-13)26-12-17-24-25-18(22-23-19(25)27-17)15-6-4-5-7-16(15)21/h4-11H,12H2,1-3H3InChIKey
PYZZVHWPQPEKDG-UHFFFAOYSA-NSynonyms
(3(2BROMOPHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)METHYL4TERTBUTYLPHENYLETHER
3(2bromophenyl)6((4tertbutylphenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)C4=CC=CC=C4Br
InChI=1SC20H19BrN4OSc120(23)1381014(11913)261217242518(222319(25)2717)15645716(15)21h411H12H213H3
MFCD06590352
ZINC000008453201
ZINC08453201
ZINC8453201
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