Vitas-M small molecule compound

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

Catalog ID
STK111385
SMILES O=c1[nH]c2cc3OCOc3cc2c(c1Sc1nc2c([nH]1)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 C18H13N3O3S MW 351.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O3S/c1-9-10-6-14-15(24-8-23-14)7-13(10)19-17(22)16(9)25-18-20-11-4-2-3-5-12(11)21-18/h2-7H,8H2,1H3,(H,19,22)(H,20,21)
InChIKey
GSBNKCJJXNRLMY-UHFFFAOYSA-N
Synonyms
517868-97-2
7((1Hbenzo(d)imidazol2yl)thio)8methyl(13)dioxolo(45g)quinolin6(5H)one
7(1HBENZIMIDAZOL2YLSULFANYL)8METHYL(13)DIOXOLO(45G)QUINOLIN6(5H)ONE
7(1HBENZIMIDAZOL2YLSULFANYL)8METHYL(13)DIOXOLO(45G)QUINOLIN6OL
7(1HBENZIMIDAZOL2YLSULFANYL)8METHYL5H(13)DIOXOLO(45G)QUINOLIN6ONE
7BENZIMIDAZOL2YLTHIO8METHYL5HYDRO2H13DIOXOLENO(45G)QUINOLIN6ONE
CC1=C(C(=O)NC2=CC3=C(C=C12)OCO3)SC4=NC5=CC=CC=C5N4
InChI=1SC18H13N3O3Sc191061415(2482314)713(10)1917(22)16(9)25182011423512(11)2118h27H8H21H3(H1922)(H2021)
MFCD03778838
O=c1(nH)c2cc3OCOc3cc2c(c1Sc1nc2c((nH)1)cccc2)C
ZINC03868583
ZINC09329234
ZINC9329234

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Available files

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