Vitas-M small molecule compound
3-(2-chlorophenyl)-2-({[4-cyclohexyl-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STK663937
SMILES Clc1ccc(c(c1)Cl)c1nnc(n1C1CCCCC1)SCc1nc2ccccc2c(=O)n1c1ccccc1Cl
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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 C29H24Cl3N5OS MW 596.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24Cl3N5OS/c30-18-14-15-20(23(32)16-18)27-34-35-29(36(27)19-8-2-1-3-9-19)39-17-26-33-24-12-6-4-10-21(24)28(38)37(26)25-13-7-5-11-22(25)31/h4-7,10-16,19H,1-3,8-9,17H2InChIKey
AYXXWGQLZYXDMM-UHFFFAOYSA-NSynonyms
3(2chlorophenyl)2(((4cyclohexyl5(24dichlorophenyl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
3(2CHLOROPHENYL)2((4CYCLOHEXYL5(24DICHLOROPHENYL)124TRIAZOL3YL)SULFANYLMETHYL)QUINAZOLIN4ONE
C1CCC(CC1)N2C(=NN=C2SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl)C6=C(C=C(C=C6)Cl)Cl
InChI=1SC29H24Cl3N5OSc3018141520(23(32)1618)27343529(36(27)198213919)391726332412641021(24)28(38)37(26)2513751122(25)31h47101619H138917H2
MFCD03768479
ZINC000098005194
ZINC98005194
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