Vitas-M small molecule compound
(5Z)-5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190049
SMILES Cc1ccc(c(c1)C)n1c(C)cc(c1C)/C=C\1/C(=O)NC(=S)N(C1=O)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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-11-6-7-17(12(2)8-11)23-13(3)9-15(14(23)4)10-16-18(24)21-20(26)22(5)19(16)25/h6-10H,1-5H3,(H,21,24,26)/b16-10-InChIKey
PJOPNKYXIISLJP-YBEGLDIGSA-NSynonyms
(5Z)5((1(24DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1METHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)5((1(24DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1METHYL2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)N(C3=O)C)C)C
Cc1ccc(c(c1)C)n1c(C)cc(c1C)C=C1C(=O)NC(=S)N(C1=O)C
InChI=1SC20H21N3O2Sc1116717(12(2)811)2313(3)915(14(23)4)101618(24)2120(26)22(5)19(16)25h610H15H3(H212426)b1610
MFCD03226776
ZINC000015012656
ZINC15012656
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