Vitas-M small molecule compound
4-{3-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}-3-methylbenzoic acid
Catalog ID
STK188163
SMILES S=C1N(C)C(=O)C(=Cc2cc(n(c2C)c2ccc(cc2C)C(=O)O)C)C(=O)N1C
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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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-11-8-14(20(27)28)6-7-17(11)24-12(2)9-15(13(24)3)10-16-18(25)22(4)21(29)23(5)19(16)26/h6-10H,1-5H3,(H,27,28)InChIKey
UDOZZFJPASXCKO-UHFFFAOYSA-NSynonyms
425660-68-04(3((13DIMETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)25DIMETHYLPYRROL1YL)3METHYLBENZOICACID
4(3((13DIMETHYL46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)25DIMETHYL1HPYRROL1YL)3METHYLBENZOICACID
425660680
CC1=CC(=C(N1C2=C(C=C(C=C2)C(=O)O)C)C)C=C3C(=O)N(C(=S)N(C3=O)C)C
InChI=1SC21H21N3O4Sc111814(20(27)28)6717(11)2412(2)915(13(24)3)101618(25)22(4)21(29)23(5)19(16)26h610H15H3(H2728)
MFCD02609093
ZINC000001101008
ZINC1101008
Check stock
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