Vitas-M small molecule compound
9-(2-methoxy-5-methylphenyl)-7,7-dimethyl-10-thioxo-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
Catalog ID
STK210064
SMILES COc1ccc(cc1n1sc2c(c1=S)c1cccc3c1N(C2(C)C)C(=O)C3=O)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 C22H18N2O3S2 MW 422.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S2/c1-11-8-9-15(27-4)14(10-11)24-21(28)16-12-6-5-7-13-17(12)23(20(26)18(13)25)22(2,3)19(16)29-24/h5-10H,1-4H3InChIKey
FBWIKSOYHOJIAI-UHFFFAOYSA-NSynonyms
728025-31-8728025318
9(2methoxy5methylphenyl)77dimethyl10thioxo910dihydro4Hisothiazolo(54c)pyrrolo(321ij)quinoline45(7H)dione
9(2methoxy5methylphenyl)77dimethyl10thioxo910dihydro7Hpyrrolo(321ij)(12)thiazolo(54c)quinoline45dione
CC1=CC(=C(C=C1)OC)N2C(=S)C3=C(S2)C(N4C5=C3C=CC=C5C(=O)C4=O)(C)C
InChI=1SC22H18N2O3S2c1118915(274)14(1011)2421(28)16126571317(12)23(20(26)18(13)25)22(23)19(16)2924h510H14H3
MFCD05843949
ZINC000002226861
ZINC02226861
ZINC2226861
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