Vitas-M small molecule compound
ethyl 5-(acetyloxy)-6-bromo-2-[(carbamimidoylsulfanyl)methyl]-1-phenyl-1H-indole-3-carboxylate
Catalog ID
STK833008
SMILES CCOC(=O)c1c2cc(OC(=O)C)c(cc2n(c1CSC(=N)N)c1ccccc1)Br
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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 C21H20BrN3O4S MW 490.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN3O4S/c1-3-28-20(27)19-14-9-18(29-12(2)26)15(22)10-16(14)25(13-7-5-4-6-8-13)17(19)11-30-21(23)24/h4-10H,3,11H2,1-2H3,(H3,23,24)InChIKey
XEYANNMNRFTJKP-UHFFFAOYSA-NSynonyms
369606-71-3369606713
5ACETOXY2((AMIDINOTHIO)METHYL)6BROMO1PHENYLINDOLE3CARBOXYLICACIDETHYLESTER
5ACETOXY6BROMO2CARBAMIMIDOYLSULFANYLMETHYL1PHENYL1HINDOLE3CARBOXYLICACIDETHYLESTER
5ACETYLOXY6BROMO2((CARBAMIMIDOYLTHIO)METHYL)1PHENYL3INDOLECARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=CC=C3)CSC(=N)N
ETHYL5(ACETYLOXY)2(((AMINO(IMINO)METHYL)SULFANYL)METHYL)6BROMO1PHENYL1HINDOLE3CARBOXYLATE
ethyl5(acetyloxy)6bromo2((carbamimidoylsulfanyl)methyl)1phenyl1Hindole3carboxylate
ethyl5acetoxy6bromo2((carbamimidoylthio)methyl)1phenyl1Hindole3carboxylate
ETHYL5ACETYLOXY6BROMANYL2(CARBAMIMIDOYLSULFANYLMETHYL)1PHENYLINDOLE3CARBOXYLATE
ETHYL5ACETYLOXY6BROMO2(CARBAMIMIDOYLSULFANYLMETHYL)1PHENYLINDOLE3CARBOXYLATE
InChI=1SC21H20BrN3O4Sc132820(27)1914918(2912(2)26)15(22)1016(14)25(137546813)17(19)113021(23)24h410H311H212H3(H32324)
MFCD01241887
ZINC000008453906
ZINC8453906
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