Vitas-M small molecule compound

2-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STK837744
SMILES Cc1nnc(s1)n1c(=O)c2cccc3c2c(c1=O)ccc3

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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 C15H9N3O2S MW 295.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9N3O2S/c1-8-16-17-15(21-8)18-13(19)10-6-2-4-9-5-3-7-11(12(9)10)14(18)20/h2-7H,1H3
InChIKey
GSISXRVKAKLETH-UHFFFAOYSA-N
Synonyms

2(5methyl134thiadiazol2yl)1Hbenzo(de)isoquinoline13(2H)dione
2(5METHYL134THIADIAZOL2YL)BENZO(DE)ISOQUINOLINE13DIONE
2(5METHYL134THIADIAZOL2YL)BENZO(DE)ISOQUINOLINE13QUINONE
CC1=NN=C(S1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
InChI=1SC15H9N3O2Sc18161715(218)1813(19)10624953711(12(9)10)14(18)20h27H1H3
MFCD00847222
ZINC000000509181
ZINC00509181
ZINC509181

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Available files

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