Vitas-M small molecule compound
1-(3-bromophenyl)-N,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STK655867
SMILES Brc1cccc(c1)c1nn2c3n1CCCCc3c(c2C(=S)Nc1ccccc1)c1ccccc1
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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/c29-21-13-9-12-20(18-21)26-31-33-25(27(34)30-22-14-5-2-6-15-22)24(19-10-3-1-4-11-19)23-16-7-8-17-32(26)28(23)33/h1-6,9-15,18H,7-8,16-17H2,(H,30,34)InChIKey
NOFVNBHZVMMXOB-UHFFFAOYSA-NSynonyms
301860-26-41(3bromophenyl)N4diphenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
301860264
4(3bromophenyl)N1diphenyl5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
C1CCN2C3=C(C1)C(=C(N3N=C2C4=CC(=CC=C4)Br)C(=S)NC5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC28H23BrN4Sc29211391220(1821)26313325(27(34)3022145261522)24(19103141119)2316781732(26)28(23)33h1691518H781617H2(H3034)
MFCD02084616
ZINC000002083253
ZINC02083253
ZINC2083253
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