Vitas-M small molecule compound
2-({[4-(2-methylpropyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Catalog ID
STL140448
SMILES CC(Cn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1c1ccccc1)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 C21H21N5OS MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5OS/c1-14(2)12-26-19(15-8-4-3-5-9-15)24-25-21(26)28-13-18-22-17-11-7-6-10-16(17)20(27)23-18/h3-11,14H,12-13H2,1-2H3,(H,22,23,27)InChIKey
MXQGVMKETWXGAE-UHFFFAOYSA-NSynonyms
2(((4(2methylpropyl)5phenyl4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((4(2methylpropyl)5phenyl124triazol3yl)sulfanylmethyl)1Hquinazolin4one
CC(C)CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4
CC(Cn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1c1ccccc1)C
InChI=1SC21H21N5OSc114(2)122619(158435915)242521(26)281318221711761016(17)20(27)2318h31114H1213H212H3(H222327)
MFCD18434937
ZINC000057291854
ZINC57291854
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