Vitas-M small molecule compound
N-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STK680707
SMILES Clc1ccc(c(c1)Cl)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 C29H23Cl3N4S MW 565.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl3N4S/c1-17-5-7-18(8-6-17)27-34-36-26(28(37)33-21-12-9-19(30)10-13-21)25(22-14-11-20(31)16-24(22)32)23-4-2-3-15-35(27)29(23)36/h5-14,16H,2-4,15H2,1H3,(H,33,37)InChIKey
SGQFIHNNWRRFCM-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2=NN3C(=C(C4=C3N2CCCC4)C5=C(C=C(C=C5)Cl)Cl)C(=S)NC6=CC=C(C=C6)Cl
InChI=1SC29H23Cl3N4Sc1175718(8617)27343626(28(37)332112919(30)101321)25(22141120(31)1624(22)32)234231535(27)29(23)36h51416H2415H21H3(H3337)
MFCD03460698
N(4chlorophenyl)1(24dichlorophenyl)4(ptolyl)5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
N(4chlorophenyl)4(24dichlorophenyl)1(4methylphenyl)5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
ZINC000001778791
ZINC01778791
ZINC1778791
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