Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(2,3-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK192740
SMILES Cc1ccc(cc1)n1c(C)cc(c1C)/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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-15-9-11-21(12-10-15)28-17(3)13-20(19(28)5)14-22-24(30)27-26(32)29(25(22)31)23-8-6-7-16(2)18(23)4/h6-14H,1-5H3,(H,27,30,32)/b22-14-InChIKey
CBBXFCDUBIEKES-HMAPJEAMSA-NSynonyms
(5Z)5((25DIMETHYL1(4METHYLPHENYL)1HPYRROL3YL)METHYLIDENE)1(23DIMETHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)5((25DIMETHYL1(4METHYLPHENYL)PYRROL3YL)METHYLIDENE)1(23DIMETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(Z)5((25dimethyl1(ptolyl)1Hpyrrol3yl)methylene)1(23dimethylphenyl)2thioxodihydropyrimidine46(1H5H)dione
CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC(=C4C)C)C
Cc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
InChI=1SC26H25N3O2Sc11591121(121015)2817(3)1320(19(28)5)142224(30)2726(32)29(25(22)31)2386716(2)18(23)4h614H15H3(H273032)b2214
MFCD02629346
ZINC000000654582
ZINC00654582
ZINC654582
Check stock
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Check stock on Vitas-MAvailable files
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