Vitas-M small molecule compound
1-(butan-2-yl)-6'-chloro-2-sulfanyl-1',2',3',3a'-tetrahydro-4H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H)-dione
Catalog ID
STK612207
SMILES CCC(N1C(=NC(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CCC1)S)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 C19H22ClN3O2S MW 391.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O2S/c1-3-11(2)23-17(25)19(16(24)21-18(23)26)10-12-13(20)6-4-7-14(12)22-9-5-8-15(19)22/h4,6-7,11,15H,3,5,8-10H2,1-2H3,(H,21,24,26)InChIKey
FJMLSUBLPZDWFA-UHFFFAOYSA-NSynonyms
1008059-91-31(butan2yl)6chloro2sulfanyl1233atetrahydro4H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)46(1H)dione
1008059913
1butan2yl6chloro2sulfanylidenespiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)46dione
CCC(C)N1C(=O)C2(CC3=C(C=CC=C3Cl)N4C2CCC4)C(=O)NC1=S
InChI=1SC19H22ClN3O2Sc1311(2)2317(25)19(16(24)2118(23)26)101213(20)64714(12)2295815(19)22h4671115H35810H212H3(H212426)
MFCD08729811
ZINC000008997354
ZINC000229920643
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