Vitas-M small molecule compound
1-(9H-fluoren-2-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanone
Catalog ID
STK126013
SMILES O=C(c1ccc2c(c1)Cc1c2cccc1)CSc1nc2c(s1)cc(cc2)[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 C22H14N2O3S2 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O3S2/c25-20(12-28-22-23-19-8-6-16(24(26)27)11-21(19)29-22)14-5-7-18-15(10-14)9-13-3-1-2-4-17(13)18/h1-8,10-11H,9,12H2InChIKey
SCGDJWWDEGQYRM-UHFFFAOYSA-NSynonyms
1(9HFLUOREN2YL)2((6NITRO13BENZOTHIAZOL2YL)SULFANYL)ETHANONE
1FLUOREN2YL2(6NITROBENZOTHIAZOL2YLTHIO)ETHAN1ONE
C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=NC5=C(S4)C=C(C=C5)(N+)(=O)(O)
InChI=1SC22H14N2O3S2c2520(12282223198616(24(26)27)1121(19)2922)14571815(1014)913312417(13)18h181011H912H2
MFCD01199497
O=C(c1ccc2c(c1)Cc1c2cccc1)CSc1nc2c(s1)cc(cc2)(N+)(=O)(O)
ZINC000003464639
ZINC03464639
ZINC3464639
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