Vitas-M small molecule compound
4-benzyl-6-ethyl-6-methyl-1-(prop-2-en-1-ylsulfanyl)-6,7-dihydrobenzo[h][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Catalog ID
STK557549
SMILES C=CCSc1nnc2n1c1c3ccccc3CC(c1c(=O)n2Cc1ccccc1)(C)CC
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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 C26H26N4OS MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4OS/c1-4-15-32-25-28-27-24-29(17-18-11-7-6-8-12-18)23(31)21-22(30(24)25)20-14-10-9-13-19(20)16-26(21,3)5-2/h4,6-14H,1,5,15-17H2,2-3H3InChIKey
QYMZBLJVEQHERN-UHFFFAOYSA-NSynonyms
575467-22-01(allylthio)4benzyl6ethyl6methyl67dihydrobenzo(h)(124)triazolo(43a)quinazolin5(4H)one
4benzyl6ethyl6methyl1(prop2en1ylsulfanyl)67dihydrobenzo(h)(124)triazolo(43a)quinazolin5(4H)one
575467220
CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C4=NN=C(N34)SCC=C)CC5=CC=CC=C5)C
InChI=1SC26H26N4OSc1415322528272429(1718117681218)23(31)2122(30(24)25)20141091319(20)1626(213)52h4614H151517H223H3
MFCD04026119
ZINC000002375513
ZINC000002375515
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