Vitas-M small molecule compound
ethyl {2-methoxy-4-[6-methyl-5-(phenylcarbamoyl)-2-sulfanyl-3,4-dihydropyrimidin-4-yl]phenoxy}acetate
Catalog ID
STK116757
SMILES CCOC(=O)COc1ccc(cc1OC)C1NC(=NC(=C1C(=O)Nc1ccccc1)C)S
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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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-4-30-19(27)13-31-17-11-10-15(12-18(17)29-3)21-20(14(2)24-23(32)26-21)22(28)25-16-8-6-5-7-9-16/h5-12,21H,4,13H2,1-3H3,(H,25,28)(H2,24,26,32)InChIKey
YJDMGBMRDGTEIN-UHFFFAOYSA-NSynonyms
CCOC(=O)COC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=CC=C3)OC
ETHYL(2METHOXY4(6METHYL5(PHENYLCARBAMOYL)2SULFANYL34DIHYDROPYRIMIDIN4YL)PHENOXY)ACETATE
ETHYL2(2METHOXY4(6METHYL5(PHENYLCARBAMOYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDIN4YL)PHENOXY)ACETATE
InChI=1SC23H25N3O5Sc143019(27)133117111015(1218(17)293)2120(14(2)2423(32)2621)22(28)25168657916h51221H413H213H3(H2528)(H2242632)
MFCD04127838
ZINC000009304750
ZINC000009805415
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