Vitas-M small molecule compound
1-(4-bromophenyl)-2-{[5-methyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK343862
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1C
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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 C14H14BrN3OS MW 352.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14BrN3OS/c1-3-8-18-10(2)16-17-14(18)20-9-13(19)11-4-6-12(15)7-5-11/h3-7H,1,8-9H2,2H3InChIKey
DGMNGGNFDUBCEH-UHFFFAOYSA-NSynonyms
1(4BROMOPHENYL)2((5METHYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4bromophenyl)2((5methyl4prop2enyl124triazol3yl)sulfanyl)ethanone
CC1=NN=C(N1CC=C)SCC(=O)C2=CC=C(C=C2)Br
InChI=1SC14H14BrN3OSc1381810(2)161714(18)20913(19)114612(15)7511h37H189H22H3
MFCD08580055
ZINC000012851268
ZINC12851268
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