Vitas-M small molecule compound
6,6-dimethyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK133041
SMILES O=C1CC(C)(C)CC2=C1C(c1ccccc1)n1c(N2)ncn1
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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 C17H18N4O MW 294.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O/c1-17(2)8-12-14(13(22)9-17)15(11-6-4-3-5-7-11)21-16(20-12)18-10-19-21/h3-7,10,15H,8-9H2,1-2H3,(H,18,19,20)InChIKey
AQWGLGSPKJXOGA-UHFFFAOYSA-NSynonyms
421586-21-2421586212
66dimethyl9phenyl1579tetrahydro(124)triazolo(51b)quinazolin8one
66dimethyl9phenyl5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
CC1(CC2=C(C(N3C(=N2)N=CN3)C4=CC=CC=C4)C(=O)C1)C
InChI=1SC17H18N4Oc117(2)81214(13(22)917)15(116435711)2116(2012)18101921h371015H89H212H3(H181920)
MFCD02370545
ZINC000018180827
ZINC000018180830
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