Vitas-M small molecule compound
(5Z)-1-(3-methylphenyl)-2-sulfanyl-5-(3,4,5-trimethoxybenzylidene)pyrimidine-4,6(1H,5H)-dione
Catalog ID
STL046906
SMILES COc1c(OC)cc(cc1OC)/C=C\1/C(=O)N=C(N(C1=O)c1cccc(c1)C)S
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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 C21H20N2O5S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5S/c1-12-6-5-7-14(8-12)23-20(25)15(19(24)22-21(23)29)9-13-10-16(26-2)18(28-4)17(11-13)27-3/h5-11H,1-4H3,(H,22,24,29)/b15-9-InChIKey
OAQNZKFRAMZOLV-DHDCSXOGSA-NSynonyms
(5Z)1(3methylphenyl)2sulfanyl5(345trimethoxybenzylidene)pyrimidine46(1H5H)dione
(5Z)1(3METHYLPHENYL)2SULFANYLIDENE5((345TRIMETHOXYPHENYL)METHYLIDENE)13DIAZINANE46DIONE
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OC)OC)C(=O)NC2=S
COc1c(OC)cc(cc1OC)C=C1C(=O)N=C(N(C1=O)c1cccc(c1)C)S
InChI=1SC21H20N2O5Sc11265714(812)2320(25)15(19(24)2221(23)29)9131016(262)18(284)17(1113)273h511H14H3(H222429)b159
MFCD03815788
ZINC09300336
ZINC9300336
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