Vitas-M small molecule compound
1-(4-bromophenyl)-4-[4-(difluoromethoxy)phenyl]-N-(3-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STK570122
SMILES FC(Oc1ccc(cc1)c1c(C(=S)Nc2cccc(c2)C)n2c3c1CCCCn3c(n2)c1ccc(cc1)Br)F
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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 C30H25BrF2N4OS MW 607.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25BrF2N4OS/c1-18-5-4-6-22(17-18)34-28(39)26-25(19-10-14-23(15-11-19)38-30(32)33)24-7-2-3-16-36-27(35-37(26)29(24)36)20-8-12-21(31)13-9-20/h4-6,8-15,17,30H,2-3,7,16H2,1H3,(H,34,39)InChIKey
BZDYAQAZHPQULJ-UHFFFAOYSA-NSynonyms
1(4bromophenyl)4(4(difluoromethoxy)phenyl)N(3methylphenyl)5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
4(4bromophenyl)1(4(difluoromethoxy)phenyl)N(mtolyl)5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
CC1=CC(=CC=C1)NC(=S)C2=C(C3=C4N2N=C(N4CCCC3)C5=CC=C(C=C5)Br)C6=CC=C(C=C6)OC(F)F
InChI=1SC30H25BrF2N4OSc11854622(1718)3428(39)2625(19101423(151119)3830(32)33)24723163627(3537(26)29(24)36)2081221(31)13920h468151730H23716H21H3(H3439)
MFCD02660252
ZINC000098000129
ZINC98000129
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