Vitas-M small molecule compound
2-(benzylsulfanyl)-9-(3-ethoxy-4-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK250461
SMILES CCOc1cc(ccc1O)C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccccc1
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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 C24H24N4O3S MW 448.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O3S/c1-2-31-20-13-16(11-12-18(20)29)22-21-17(9-6-10-19(21)30)25-23-26-24(27-28(22)23)32-14-15-7-4-3-5-8-15/h3-5,7-8,11-13,22,29H,2,6,9-10,14H2,1H3,(H,25,26,27)InChIKey
ITRCMMIAFPYWND-UHFFFAOYSA-NSynonyms
727402-34-82(benzylsulfanyl)9(3ethoxy4hydroxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2(benzylthio)9(3ethoxy4hydroxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2benzylsulfanyl9(3ethoxy4hydroxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
727402348
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)N=C4N2NC(=N4)SCC5=CC=CC=C5)O
InChI=1SC24H24N4O3Sc1231201316(111218(20)29)222117(961019(21)30)25232624(2728(22)23)3214157435815h357811132229H2691014H21H3(H252627)
MFCD06193097
ZINC000009237560
ZINC000009237562
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