Vitas-M small molecule compound
methyl {3-[6-methyl-5-(phenylcarbamoyl)-2-sulfanyl-3,4-dihydropyrimidin-4-yl]phenoxy}acetate
Catalog ID
STK108494
SMILES COC(=O)COc1cccc(c1)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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-13-18(20(26)23-15-8-4-3-5-9-15)19(24-21(29)22-13)14-7-6-10-16(11-14)28-12-17(25)27-2/h3-11,19H,12H2,1-2H3,(H,23,26)(H2,22,24,29)InChIKey
WFSRCNZDJBRWTH-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)OCC(=O)OC)C(=O)NC3=CC=CC=C3
InChI=1SC21H21N3O4Sc11318(20(26)23158435915)19(2421(29)2213)14761016(1114)281217(25)272h31119H12H212H3(H2326)(H2222429)
METHYL(3(6METHYL5(PHENYLCARBAMOYL)2SULFANYL34DIHYDROPYRIMIDIN4YL)PHENOXY)ACETATE
METHYL2(3(6METHYL5(PHENYLCARBAMOYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDIN4YL)PHENOXY)ACETATE
MFCD03716300
ZINC000005563869
ZINC000005563894
ZINC01113134
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