Vitas-M small molecule compound
(5E)-5-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-1-(2,3-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK117832
SMILES Clc1cccc(c1)c1ccc(o1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
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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 C23H17ClN2O3S MW 436.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN2O3S/c1-13-5-3-8-19(14(13)2)26-22(28)18(21(27)25-23(26)30)12-17-9-10-20(29-17)15-6-4-7-16(24)11-15/h3-12H,1-2H3,(H,25,27,30)/b18-12+InChIKey
ZHUCAFDHLXNOHJ-LDADJPATSA-NSynonyms
(5E)5((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)1(23DIMETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)1(23DIMETHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)Cl)C(=O)NC2=S)C
Clc1cccc(c1)c1ccc(o1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
InChI=1SC23H17ClN2O3Sc11353819(14(13)2)2622(28)18(21(27)2523(26)30)121791020(2917)1564716(24)1115h312H12H3(H252730)b1812+
MFCD04128667
ZINC000009805500
ZINC09805500
ZINC9805500
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