Vitas-M small molecule compound
7'-[(Z)-(1-ethyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-1,3-dimethyl-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
STK576430
SMILES CCN1C(=NC(=O)/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S
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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 C24H25N5O5S MW 495.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O5S/c1-4-28-19(31)15(18(30)25-22(28)35)11-13-7-8-16-14(10-13)12-24(17-6-5-9-29(16)17)20(32)26(2)23(34)27(3)21(24)33/h7-8,10-11,17H,4-6,9,12H2,1-3H3,(H,25,30,35)/b15-11-InChIKey
SSHZGLYTPFHBTA-PTNGSMBKSA-NSynonyms
902321-54-4(Z)7((1ethyl2mercapto46dioxo16dihydropyrimidin5(4H)ylidene)methyl)13dimethyl233a5tetrahydro1H1Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(3H)trione
7((Z)(1ethyl46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)13dimethyl1233atetrahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinoline)246(1H3H)trione
7((Z)(1ethyl46dioxo2sulfanylidene13diazinan5ylidene)methyl)13dimethylspiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)246trione
902321544
CCN1C(=NC(=O)C(=Cc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O)S
CCN1C(=O)C(=CC2=CC3=C(C=C2)N4CCCC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)C(=O)NC1=S
InChI=1SC24H25N5O5Sc142819(31)15(18(30)2522(28)35)1113781614(1013)1224(1765929(16)17)20(32)26(2)23(34)27(3)21(24)33h78101117H46912H213H3(H253035)b1511
MFCD06790237
ZINC000009348594
ZINC000009348596
Check stock
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Check stock on Vitas-MAvailable files
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