Vitas-M small molecule compound
2-{[4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-tribromophenyl)acetamide
Catalog ID
STL048346
SMILES C=CCn1c(SCC(=O)Nc2c(Br)cc(cc2Br)Br)nnc1c1ccccn1
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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 C18H14Br3N5OS MW 588.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Br3N5OS/c1-2-7-26-17(14-5-3-4-6-22-14)24-25-18(26)28-10-15(27)23-16-12(20)8-11(19)9-13(16)21/h2-6,8-9H,1,7,10H2,(H,23,27)InChIKey
DQUWQGROJMQSHJ-UHFFFAOYSA-NSynonyms
618880-30-12((4(prop2en1yl)5(pyridin2yl)4H124triazol3yl)sulfanyl)N(246tribromophenyl)acetamide
2((4ALLYL5(PYRIDIN2YL)4H124TRIAZOL3YL)THIO)N(246TRIBROMOPHENYL)ACETAMIDE
2((4PROP2ENYL5PYRIDIN2YL124TRIAZOL3YL)SULFANYL)N(246TRIBROMOPHENYL)ACETAMIDE
2(4PROP2ENYL5(2PYRIDYL)(124TRIAZOL3YLTHIO))N(246TRIBROMOPHENYL)ACETAMIDE
618880301
C=CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2Br)Br)Br)C3=CC=CC=N3
InChI=1SC18H14Br3N5OSc1272617(1453462214)242518(26)281015(27)231612(20)811(19)913(16)21h2689H1710H2(H2327)
MFCD04012800
ZINC000001283253
ZINC01283253
ZINC1283253
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