Vitas-M small molecule compound

8-methyl-7-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl][1,3]dioxolo[4,5-g]quinolin-6(5H)-one

Catalog ID
STK112761
SMILES Cc1cc(=O)[nH]c(n1)Sc1c(=O)[nH]c2c(c1C)cc1c(c2)OCO1

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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 C16H13N3O4S MW 343.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4S/c1-7-3-13(20)19-16(17-7)24-14-8(2)9-4-11-12(23-6-22-11)5-10(9)18-15(14)21/h3-5H,6H2,1-2H3,(H,18,21)(H,17,19,20)
InChIKey
RGTKDOLUQPAOEB-UHFFFAOYSA-N
Synonyms

8METHYL7((4METHYL6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)(13)DIOXOLO(45G)QUINOLIN6(5H)ONE
8METHYL7((6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)5H(13)DIOXOLO(45G)QUINOLIN6ONE
8METHYL7(6METHYL4OXO(3HYDROPYRIMIDIN2YLTHIO))5HYDRO2H13DIOXOLENO(45G)QUINOLIN6ONE
CC1=CC(=O)N=C(N1)SC2=C(C3=CC4=C(C=C3NC2=O)OCO4)C
Cc1cc(=O)(nH)c(n1)Sc1c(=O)(nH)c2c(c1C)cc1c(c2)OCO1
InChI=1SC16H13N3O4Sc17313(20)1916(177)24148(2)941112(2362211)510(9)1815(14)21h35H6H212H3(H1821)(H171920)
MFCD03778840
ZINC000005095357
ZINC5095357

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Available files

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