Vitas-M small molecule compound
2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-tribromophenyl)acetamide
Catalog ID
STL041531
SMILES Brc1cc(Br)c(c(c1)Br)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccco1
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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 C19H13Br3N4O3S MW 617.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Br3N4O3S/c20-11-7-13(21)17(14(22)8-11)23-16(27)10-30-19-25-24-18(15-4-2-6-29-15)26(19)9-12-3-1-5-28-12/h1-8H,9-10H2,(H,23,27)InChIKey
TXKOOEBZTQCXTD-UHFFFAOYSA-NSynonyms
2((5(FURAN2YL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)N(246TRIBROMOPHENYL)ACETAMIDE
2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)N(246tribromophenyl)acetamide
2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)thio)N(246tribromophenyl)acetamide
2(5(2FURYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))N(246TRIBROMOPHENYL)ACETAMIDE
C1=COC(=C1)CN2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3Br)Br)Br)C4=CC=CO4
InChI=1SC19H13Br3N4O3Sc2011713(21)17(14(22)811)2316(27)103019252418(154262915)26(19)9123152812h18H910H2(H2327)
MFCD05726439
ZINC000150406640
ZINC150406640
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