Vitas-M small molecule compound
(5E)-1-(3-chloro-2-methylphenyl)-5-(4-methoxy-3-methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK189448
SMILES COc1ccc(cc1C)/C=C/1\C(=O)NC(=S)N(C1=O)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 C20H17ClN2O3S MW 400.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O3S/c1-11-9-13(7-8-17(11)26-3)10-14-18(24)22-20(27)23(19(14)25)16-6-4-5-15(21)12(16)2/h4-10H,1-3H3,(H,22,24,27)/b14-10+InChIKey
FCLIIVIIRRMRCR-GXDHUFHOSA-NSynonyms
(5E)1(3CHLORO2METHYLPHENYL)5((4METHOXY3METHYLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(3CHLORO2METHYLPHENYL)5(4METHOXY3METHYLBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)C)OC
COc1ccc(cc1C)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)Cl
InChI=1SC20H17ClN2O3Sc111913(7817(11)263)101418(24)2220(27)23(19(14)25)1664515(21)12(16)2h410H13H3(H222427)b1410+
MFCD03923140
ZINC000002830496
ZINC02830496
ZINC2830496
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