Vitas-M small molecule compound
N,4-bis(4-chlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STK768925
SMILES Clc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccc(cc1)Cl)nc3c1ccc(cc1)C
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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 C29H24Cl2N4S MW 531.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24Cl2N4S/c1-18-5-7-20(8-6-18)27-33-35-26(28(36)32-23-15-13-22(31)14-16-23)25(19-9-11-21(30)12-10-19)24-4-2-3-17-34(27)29(24)35/h5-16H,2-4,17H2,1H3,(H,32,36)InChIKey
QWGAZYGGMNFJIY-UHFFFAOYSA-NSynonyms
524036-35-9524036359
CC1=CC=C(C=C1)C2=NN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Cl)C(=S)NC6=CC=C(C=C6)Cl
InChI=1SC29H24Cl2N4Sc1185720(8618)27333526(28(36)3223151322(31)141623)25(1991121(30)121019)244231734(27)29(24)35h516H2417H21H3(H3236)
MFCD03408128
N1bis(4chlorophenyl)4(ptolyl)5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
N4bis(4chlorophenyl)1(4methylphenyl)5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
ZINC000002192675
ZINC2192675
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