Vitas-M small molecule compound

2-[2-(4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-4-nitro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK082108
SMILES S=c1ssc2c1c1ccccc1N(C2(C)C)C(=O)CN1C(=O)c2c(C1=O)cccc2[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 C22H15N3O5S3 MW 497.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O5S3/c1-22(2)18-17(21(31)33-32-18)11-6-3-4-8-13(11)24(22)15(26)10-23-19(27)12-7-5-9-14(25(29)30)16(12)20(23)28/h3-9H,10H2,1-2H3
InChIKey
CLEUAGRIIDEAFW-UHFFFAOYSA-N
Synonyms
372501-28-5
2(2(44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)2OXOETHYL)4NITROISOINDOLE13DIONE
2(2(44DIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL))2OXOETHYL)4NITROBENZO(C)AZOLINE13DIONE
2(2(44DIMETHYL1THIOXO14DIHYDRO5H(12)DITHIOLO(34C)QUINOLIN5YL)2OXOETHYL)4NITRO1HISOINDOLE13(2H)DIONE
2(2(44dimethyl1thioxo1H(12)dithiolo(34c)quinolin5(4H)yl)2oxoethyl)4nitroisoindoline13dione
372501285
CC1(C2=C(C3=CC=CC=C3N1C(=O)CN4C(=O)C5=C(C4=O)C(=CC=C5)(N+)(=O)(O))C(=S)SS2)C
InChI=1SC22H15N3O5S3c122(2)1817(21(31)333218)11634813(11)24(22)15(26)102319(27)1275914(25(29)30)16(12)20(23)28h39H10H212H3
MFCD01944556
S=c1ssc2c1c1ccccc1N(C2(C)C)C(=O)CN1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
STK082108
ZINC000001867612
ZINC01867612
ZINC1867612

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Available files

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