Vitas-M small molecule compound
3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(1,3-thiazol-2-yl)benzamide
Catalog ID
STK156272
SMILES O=C(c1cccc(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-])Nc1nccs1
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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 C22H12N4O5S MW 444.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12N4O5S/c27-19(24-22-23-9-10-32-22)12-3-1-4-13(11-12)25-20(28)15-6-2-5-14-17(26(30)31)8-7-16(18(14)15)21(25)29/h1-11H,(H,23,24,27)InChIKey
HPELKXLXQUADAM-UHFFFAOYSA-NSynonyms
3(13DIKETO6NITROBENZO(DE)ISOQUINOLIN2YL)NTHIAZOL2YLBENZAMIDE
3(6NITRO13BIS(OXIDANYLIDENE)BENZO(DE)ISOQUINOLIN2YL)N(13THIAZOL2YL)BENZAMIDE
3(6NITRO13DIOXO1H3HBENZO(DE)ISOQUINOLIN2YL)NTHIAZOL2YLBENZAMIDE
3(6NITRO13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)N(13THIAZOL2YL)BENZAMIDE
3(6NITRO13DIOXO2BENZO(DE)ISOQUINOLINYL)N(2THIAZOLYL)BENZAMIDE
3(6NITRO13DIOXOBENZO(DE)ISOQUINOLIN2YL)N(13THIAZOL2YL)BENZAMIDE
C1=CC(=CC(=C1)N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O)C(=O)NC5=NC=CS5
InChI=1SC22H12N4O5Sc2719(2422239103222)1231413(1112)2520(28)156251417(26(30)31)8716(18(14)15)21(25)29h111H(H232427)
MFCD01604559
O=C(c1cccc(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O))Nc1nccs1
ZINC000002909609
ZINC02909609
ZINC2909609
Check stock
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Check stock on Vitas-MAvailable files
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