Vitas-M small molecule compound
4-(4-bromophenyl)-N,1-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STK618225
SMILES Brc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccccc1)nc3c1ccccc1
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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 C28H23BrN4S MW 527.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23BrN4S/c29-21-16-14-19(15-17-21)24-23-13-7-8-18-32-26(20-9-3-1-4-10-20)31-33(28(23)32)25(24)27(34)30-22-11-5-2-6-12-22/h1-6,9-12,14-17H,7-8,13,18H2,(H,30,34)InChIKey
CWGJLTJFIGZZHO-UHFFFAOYSA-NSynonyms
540773-17-91(4bromophenyl)N4diphenyl5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
4(4bromophenyl)N1diphenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
540773179
C1CCN2C3=C(C1)C(=C(N3N=C2C4=CC=CC=C4)C(=S)NC5=CC=CC=C5)C6=CC=C(C=C6)Br
InChI=1SC28H23BrN4Sc2921161419(151721)24231378183226(2093141020)3133(28(23)32)25(24)27(34)3022115261222h169121417H781318H2(H3034)
MFCD03460374
ZINC000002245431
ZINC2245431
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