Vitas-M small molecule compound
2-{2-[6-phenyl-5-(phenylcarbonyl)-2-thioxo-1,2,3,4-tetrahydropyrimidin-4-yl]phenoxy}acetamide
Catalog ID
STL181547
SMILES NC(=O)COc1ccccc1C1NC(=S)NC(=C1C(=O)c1ccccc1)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 C25H21N3O3S MW 443.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3S/c26-20(29)15-31-19-14-8-7-13-18(19)23-21(24(30)17-11-5-2-6-12-17)22(27-25(32)28-23)16-9-3-1-4-10-16/h1-14,23H,15H2,(H2,26,29)(H2,27,28,32)InChIKey
PRDXVEQETXDDRJ-UHFFFAOYSA-NSynonyms
2(2(5benzoyl6phenyl2sulfanylidene34dihydro1Hpyrimidin4yl)phenoxy)acetamide
2(2(6phenyl5(phenylcarbonyl)2thioxo1234tetrahydropyrimidin4yl)phenoxy)acetamide
C1=CC=C(C=C1)C2=C(C(NC(=S)N2)C3=CC=CC=C3OCC(=O)N)C(=O)C4=CC=CC=C4
InChI=1SC25H21N3O3Sc2620(29)15311914871318(19)2321(24(30)17115261217)22(2725(32)2823)1693141016h11423H15H2(H22629)(H2272832)
MFCD06197505
ZINC000016477935
ZINC000016477938
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