Vitas-M small molecule compound
1,3-dimethyl-7'-{[(E)-(1-methyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]amino}-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Catalog ID
STK577557
SMILES SC1=NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=O)N1C
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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 C23H24N6O5S MW 496.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O5S/c1-26-18(31)14(17(30)25-21(26)35)11-24-13-6-7-15-12(9-13)10-23(16-5-4-8-29(15)16)19(32)27(2)22(34)28(3)20(23)33/h6-7,9,11,16,24H,4-5,8,10H2,1-3H3,(H,25,30,35)/b14-11+InChIKey
RLMRGGMFPSUTHZ-SDNWHVSQSA-NSynonyms
(E)7(((2mercapto1methyl46dioxo16dihydropyrimidin5(4H)ylidene)methyl)amino)13dimethyl233a5tetrahydro1H1Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(3H)trione
13dimethyl7(((E)(1methyl46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)amino)1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trione
13dimethyl7(((E)(1methyl46dioxo2sulfanylidene13diazinan5ylidene)methyl)amino)spiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
CN1C(=O)C(=CNC2=CC3=C(C=C2)N4CCCC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)C(=O)NC1=S
InChI=1SC23H24N6O5Sc12618(31)14(17(30)2521(26)35)112413671512(913)1023(1654829(15)16)19(32)27(2)22(34)28(3)20(23)33h679111624H45810H213H3(H253035)b1411+
MFCD06789885
SC1=NC(=O)C(=CNc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C(=O)N1C
ZINC000009433872
ZINC000009433873
Check stock
See real-time availability and sample size for STK577557 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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