Vitas-M small molecule compound
1-(3-chloro-4-methylphenyl)-3-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL367518
SMILES O=C1CC(=O)N(C(=S)N1c1ccc(c(c1)Cl)C)c1ccccc1
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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 C17H13ClN2O2S MW 344.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O2S/c1-11-7-8-13(9-14(11)18)20-16(22)10-15(21)19(17(20)23)12-5-3-2-4-6-12/h2-9H,10H2,1H3InChIKey
IKNFJADFBUCXOU-UHFFFAOYSA-NSynonyms
1(3chloro4methylphenyl)3phenyl2sulfanylidene13diazinane46dione
1(3chloro4methylphenyl)3phenyl2thioxodihydropyrimidine46(1H5H)dione
CC1=C(C=C(C=C1)N2C(=O)CC(=O)N(C2=S)C3=CC=CC=C3)Cl
InChI=1SC17H13ClN2O2Sc1117813(914(11)18)2016(22)1015(21)19(17(20)23)125324612h29H10H21H3
MFCD28951843
ZINC000101150492
ZINC101150492
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