Vitas-M small molecule compound
9-(3-nitrophenyl)-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK334737
SMILES O=C1CC(CC2=C1C(c1cccc(c1)[N+](=O)[O-])n1c(N2)ncn1)c1cccs1
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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 C19H15N5O3S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O3S/c25-15-9-12(16-5-2-6-28-16)8-14-17(15)18(23-19(22-14)20-10-21-23)11-3-1-4-13(7-11)24(26)27/h1-7,10,12,18H,8-9H2,(H,20,21,22)InChIKey
YXBIBRAWAVPYQB-UHFFFAOYSA-NSynonyms
951920-70-09(3nitrophenyl)6(thiophen2yl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3nitrophenyl)6thiophen2yl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
951920700
C1C(CC(=O)C2=C1N=C3N=CNN3C2C4=CC(=CC=C4)(N+)(=O)(O))C5=CC=CS5
InChI=1SC19H15N5O3Sc2515912(165262816)81417(15)18(2319(2214)20102123)1131413(711)24(26)27h17101218H89H2(H202122)
MFCD09963591
O=C1CC(CC2=C1C(c1cccc(c1)(N+)(=O)(O))n1c(N2)ncn1)c1cccs1
ZINC000018197366
ZINC000018197371
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