Vitas-M small molecule compound

7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl[1,3]dioxolo[4,5-g]quinolin-6(5H)-one

Catalog ID
STK261656
SMILES O=c1[nH]c2cc3OCOc3cc2c(c1Sc1nc2c(s1)cccc2)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 C18H12N2O3S2 MW 368.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O3S2/c1-9-10-6-13-14(23-8-22-13)7-12(10)19-17(21)16(9)25-18-20-11-4-2-3-5-15(11)24-18/h2-7H,8H2,1H3,(H,19,21)
InChIKey
NXSISTWUDFKGKE-UHFFFAOYSA-N
Synonyms

7(13benzothiazol2ylsulfanyl)8methyl(13)dioxolo(45g)quinolin6(5H)one
7(13BENZOTHIAZOL2YLSULFANYL)8METHYL5H(13)DIOXOLO(45G)QUINOLIN6ONE
7BENZOTHIAZOL2YLTHIO8METHYL5HYDRO2H13DIOXOLENO(45G)QUINOLIN6ONE
CC1=C(C(=O)NC2=CC3=C(C=C12)OCO3)SC4=NC5=CC=CC=C5S4
InChI=1SC18H12N2O3S2c191061314(2382213)712(10)1917(21)16(9)25182011423515(11)2418h27H8H21H3(H1921)
MFCD03488797
O=c1(nH)c2cc3OCOc3cc2c(c1Sc1nc2c(s1)cccc2)C
ZINC000003641000
ZINC03641000
ZINC3641000

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Available files

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