Vitas-M small molecule compound

3-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]-8-nitro-2H-chromen-2-one

Catalog ID
STK803824
SMILES O=c1oc2c(cc1c1scc(n1)c1ccc3c(c1)cccc3)cccc2[N+](=O)[O-]

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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 C22H12N2O4S MW 400.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12N2O4S/c25-22-17(11-16-6-3-7-19(24(26)27)20(16)28-22)21-23-18(12-29-21)15-9-8-13-4-1-2-5-14(13)10-15/h1-12H
InChIKey
ILPGMRBIPQCZNY-UHFFFAOYSA-N
Synonyms
683259-03-2
3(4(naphthalen2yl)13thiazol2yl)8nitro2Hchromen2one
3(4(naphthalen2yl)thiazol2yl)8nitro2Hchromen2one
3(4NAPHTHALEN2YL13THIAZOL2YL)8NITROCHROMEN2ONE
683259032
C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)C4=CC5=C(C(=CC=C5)(N+)(=O)(O))OC4=O
InChI=1SC22H12N2O4Sc252217(111663719(24(26)27)20(16)2822)212318(122921)159813412514(13)1015h112H
MFCD03668678
O=c1oc2c(cc1c1scc(n1)c1ccc3c(c1)cccc3)cccc2(N+)(=O)(O)
ZINC000002197543
ZINC02197543
ZINC2197543

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Available files

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