Vitas-M small molecule compound
1-(4-bromophenyl)-2-{[5-(4-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK130307
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1c1ccc(cc1)OC
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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 C20H18BrN3O2S MW 444.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O2S/c1-3-12-24-19(15-6-10-17(26-2)11-7-15)22-23-20(24)27-13-18(25)14-4-8-16(21)9-5-14/h3-11H,1,12-13H2,2H3InChIKey
RCLNKUBRYNVKEI-UHFFFAOYSA-NSynonyms
1(4BROMOPHENYL)2((5(4METHOXYPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4BROMOPHENYL)2((5(4METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANONE
COC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)C3=CC=C(C=C3)Br
InChI=1SC20H18BrN3O2Sc13122419(1561017(262)11715)222320(24)271318(25)144816(21)9514h311H11213H22H3
MFCD05990057
ZINC000001120159
ZINC01120159
ZINC1120159
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