Vitas-M small molecule compound
(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(2-methylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL049181
SMILES Clc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1C)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 C24H20ClN3O2S MW 449.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O2S/c1-14-6-4-5-7-21(14)28-23(30)20(22(29)26-24(28)31)13-17-12-15(2)27(16(17)3)19-10-8-18(25)9-11-19/h4-13H,1-3H3,(H,26,29,31)/b20-13-InChIKey
RIWZFVRFJLHDAH-MOSHPQCFSA-NSynonyms
840517-29-5(5Z)5((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)1(2methylphenyl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1(4CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2METHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
840517295
CC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)Cl)C)C(=O)NC2=S
Clc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1ccccc1C)S
InChI=1SC24H20ClN3O2Sc114645721(14)2823(30)20(22(29)2624(28)31)13171215(2)27(16(17)3)1910818(25)91119h413H13H3(H262931)b2013
MFCD07212012
ZINC000009453216
ZINC09453216
ZINC9453216
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