Vitas-M small molecule compound
(5E)-1-(3-chloro-2-methylphenyl)-5-{[2,5-dimethyl-1-(pyridin-2-yl)-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK104906
SMILES O=C1NC(=S)N(C(=O)/C/1=C/c1cc(n(c1C)c1ccccn1)C)c1cccc(c1C)Cl
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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 C23H19ClN4O2S MW 450.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4O2S/c1-13-11-16(15(3)27(13)20-9-4-5-10-25-20)12-17-21(29)26-23(31)28(22(17)30)19-8-6-7-18(24)14(19)2/h4-12H,1-3H3,(H,26,29,31)/b17-12+InChIKey
LFCDOPLAYAXLTF-SFQUDFHCSA-NSynonyms
(5E)1(3CHLORO2METHYLPHENYL)5((25DIMETHYL1(PYRIDIN2YL)1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(3CHLORO2METHYLPHENYL)5((25DIMETHYL1PYRIDIN2YLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1C2=CC=CC=N2)C)C=C3C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)C
InChI=1SC23H19ClN4O2Sc1131116(15(3)27(13)20945102520)121721(29)2623(31)28(22(17)30)1986718(24)14(19)2h412H13H3(H262931)b1712+
MFCD04126955
O=C1NC(=S)N(C(=O)C1=Cc1cc(n(c1C)c1ccccn1)C)c1cccc(c1C)Cl
ZINC000012464723
ZINC12464723
Check stock
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