Vitas-M small molecule compound
2-{2-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}-N-(4-fluorophenyl)acetamide
Catalog ID
STK187368
SMILES O=C(Nc1ccc(cc1)F)COc1ccccc1C=C1C(=O)N(C)C(=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 C21H18FN3O4S MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O4S/c1-24-19(27)16(20(28)25(2)21(24)30)11-13-5-3-4-6-17(13)29-12-18(26)23-15-9-7-14(22)8-10-15/h3-11H,12H2,1-2H3,(H,23,26)InChIKey
YJMPZEWPRBTNIX-UHFFFAOYSA-NSynonyms
2(2((13dimethyl46dioxo2sulfanylidene13diazinan5ylidene)methyl)phenoxy)N(4fluorophenyl)acetamide
2(2((13DIMETHYL46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)N(4FLUOROPHENYL)ACETAMIDE
CN1C(=O)C(=CC2=CC=CC=C2OCC(=O)NC3=CC=C(C=C3)F)C(=O)N(C1=S)C
InChI=1SC21H18FN3O4Sc12419(27)16(20(28)25(2)21(24)30)1113534617(13)291218(26)23159714(22)81015h311H12H212H3(H2326)
MFCD03232290
ZINC000009907487
ZINC09907487
ZINC9907487
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