Vitas-M small molecule compound
4-[(4,6-dioxo-1,3-diphenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenyl acetate
Catalog ID
STL380274
SMILES CC(=O)Oc1ccc(cc1)/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
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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 C25H18N2O4S MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O4S/c1-17(28)31-21-14-12-18(13-15-21)16-22-23(29)26(19-8-4-2-5-9-19)25(32)27(24(22)30)20-10-6-3-7-11-20/h2-16H,1H3InChIKey
RWYLGOIAXRHVEH-UHFFFAOYSA-NSynonyms
(4((46DIOXO13DIPHENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENYL)ACETATE
4((46DIOXO13DIPHENYL2THIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)PHENYLACETATE
4((46dioxo13diphenyl2thioxotetrahydropyrimidin5(2H)ylidene)methyl)phenylacetate
CC(=O)OC1=CC=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4
CC(=O)Oc1ccc(cc1)C=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
InChI=1SC25H18N2O4Sc117(28)3121141218(131521)162223(29)26(198425919)25(32)27(24(22)30)20106371120h216H1H3
MFCD03906010
ZINC000000682033
ZINC00682033
ZINC682033
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