Vitas-M small molecule compound
(5E)-1-(2,3-dichlorophenyl)-5-[3-iodo-5-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK196950
SMILES COc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)c2cccc(c2Cl)Cl)cc(c1OCc1cccc2c1cccc2)I
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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 C29H19Cl2IN2O4S MW 689.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19Cl2IN2O4S/c1-37-24-14-16(13-22(32)26(24)38-15-18-8-4-7-17-6-2-3-9-19(17)18)12-20-27(35)33-29(39)34(28(20)36)23-11-5-10-21(30)25(23)31/h2-14H,15H2,1H3,(H,33,35,39)/b20-12+InChIKey
XMQDAFJAXBMILY-UDWIEESQSA-NSynonyms
(5E)1(23DICHLOROPHENYL)5((3IODO5METHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(23DICHLOROPHENYL)5(3IODO5METHOXY4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(23DICHLOROPHENYL)5((3IODO5METHOXY4(NAPHTHYLMETHOXY)PHENYL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)Cl)I)OCC4=CC=CC5=CC=CC=C54
COc1cc(C=C2C(=O)NC(=S)N(C2=O)c2cccc(c2Cl)Cl)cc(c1OCc1cccc2c1cccc2)I
InChI=1SC29H19Cl2IN2O4Sc137241416(1322(32)26(24)38151884717623919(17)18)122027(35)3329(39)34(28(20)36)231151021(30)25(23)31h214H15H21H3(H333539)b2012+
MFCD02305696
ZINC000150346143
ZINC150346143
Check stock
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Check stock on Vitas-MAvailable files
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