Vitas-M small molecule compound
methyl 2-({[(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK211770
SMILES COC(=O)c1ccccc1NC(=O)CSc1[nH]c(=O)cc(n1)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 C20H17N3O4S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O4S/c1-27-19(26)14-9-5-6-10-15(14)21-18(25)12-28-20-22-16(11-17(24)23-20)13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H,21,25)(H,22,23,24)InChIKey
KBLLQYKTVABWLZ-UHFFFAOYSA-NSynonyms
825658-29-5825658295
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3
COC(=O)c1ccccc1NC(=O)CSc1(nH)c(=O)cc(n1)c1ccccc1
InChI=1SC20H17N3O4Sc12719(26)149561015(14)2118(25)1228202216(1117(24)2320)137324813h211H12H21H3(H2125)(H222324)
METHYL2((((6OXO4PHENYL16DIHYDROPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL2((2((4OXO6PHENYL1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD06624352
ZINC000001050804
ZINC01050804
ZINC1050804
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