Vitas-M small molecule compound

6,6-dimethyl-2-(methylsulfanyl)-9-(3-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol

Catalog ID
STK595847
SMILES CSc1nc2n(n1)C(c1cccc(c1)[N+](=O)[O-])C1=C(O)CC(CC1=N2)(C)C

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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 C18H19N5O3S MW 385.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O3S/c1-18(2)8-12-14(13(24)9-18)15(10-5-4-6-11(7-10)23(25)26)22-16(19-12)20-17(21-22)27-3/h4-7,15,24H,8-9H2,1-3H3
InChIKey
MPVFBJMZQRZTGO-UHFFFAOYSA-N
Synonyms

66dimethyl2(methylsulfanyl)9(3nitrophenyl)5679tetrahydro(124)triazolo(51b)quinazolin8ol
CSc1nc2n(n1)C(c1cccc(c1)(N+)(=O)(O))C1=C(O)CC(CC1=N2)(C)C
MFCD07211589
ZINC000102678733
ZINC000102678734

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.