Vitas-M small molecule compound
9-(3-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK232078
SMILES CSc1nn2c(n1)NC1=C(C2c2cccc(c2)C)C(=O)CCC1
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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 C17H18N4OS MW 326.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4OS/c1-10-5-3-6-11(9-10)15-14-12(7-4-8-13(14)22)18-16-19-17(23-2)20-21(15)16/h3,5-6,9,15H,4,7-8H2,1-2H3,(H,18,19,20)InChIKey
AFMQMRCPSXSRKR-UHFFFAOYSA-NSynonyms
727395-19-92(methylthio)9(mtolyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
727395199
9(3methylphenyl)2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3methylphenyl)2methylsulfanyl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CC1=CC=CC(=C1)C2C3=C(CCCC3=O)N=C4N2NC(=N4)SC
InChI=1SC17H18N4OSc11053611(910)151412(74813(14)22)18161917(232)2021(15)16h356915H478H212H3(H181920)
MFCD06192997
ZINC000004436081
ZINC000004436084
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