Vitas-M small molecule compound

(4,4-dimethyl-8-nitro-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-ethoxyphenyl)methanone

Catalog ID
STK789324
SMILES CCOc1cccc(c1)C(=O)N1c2ccc(cc2c2c(C1(C)C)ssc2=S)[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 C21H18N2O4S3 MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4S3/c1-4-27-14-7-5-6-12(10-14)19(24)22-16-9-8-13(23(25)26)11-15(16)17-18(21(22,2)3)29-30-20(17)28/h5-11H,4H2,1-3H3
InChIKey
LGHIDIHZYCOLEG-UHFFFAOYSA-N
Synonyms
330181-48-1
(44DIMETHYL8NITRO1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)(3ETHOXYPHENYL)METHANONE
(44dimethyl8nitro1thioxo14dihydro5H(12)dithiolo(34c)quinolin5yl)(3ethoxyphenyl)methanone
(44dimethyl8nitro1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)(3ethoxyphenyl)methanone
330181481
44DIMETHYL8NITRO1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL)3ETHOXYPHENYLKETONE
CCOC1=CC=CC(=C1)C(=O)N2C3=C(C=C(C=C3)(N+)(=O)(O))C4=C(C2(C)C)SSC4=S
CCOc1cccc(c1)C(=O)N1c2ccc(cc2c2c(C1(C)C)ssc2=S)(N+)(=O)(O)
InChI=1SC21H18N2O4S3c14271475612(1014)19(24)22169813(23(25)26)1115(16)1718(21(222)3)293020(17)28h511H4H213H3
MFCD01068096
ZINC000006631291
ZINC06631291
ZINC6631291

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Available files

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