Vitas-M small molecule compound
2-(methylsulfanyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK217848
SMILES CSc1nc2n(n1)C(C1=C(N2)CCCC1=O)c1ccc(c(c1OC)OC)OC
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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 C19H22N4O4S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O4S/c1-25-13-9-8-10(16(26-2)17(13)27-3)15-14-11(6-5-7-12(14)24)20-18-21-19(28-4)22-23(15)18/h8-9,15H,5-7H2,1-4H3,(H,20,21,22)InChIKey
UIONVOABJBNGKY-UHFFFAOYSA-NSynonyms
698374-40-22(methylsulfanyl)9(234trimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2(methylthio)9(234trimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2methylsulfanyl9(234trimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
698374402
COC1=C(C(=C(C=C1)C2C3=C(CCCC3=O)N=C4N2NC(=N4)SC)OC)OC
InChI=1SC19H22N4O4Sc125139810(16(262)17(13)273)151411(65712(14)24)20182119(284)2223(15)18h8915H57H214H3(H202122)
MFCD05030729
ZINC000004716091
ZINC000004716092
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