Vitas-M small molecule compound
methyl 2-{[({5-[(4-ethoxyphenyl)sulfonyl]-6-oxo-1,6-dihydropyrimidin-2-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STL145770
SMILES CCOc1ccc(cc1)S(=O)(=O)c1cnc([nH]c1=O)SCC(=O)Nc1ccccc1C(=O)OC
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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 C22H21N3O7S2 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O7S2/c1-3-32-14-8-10-15(11-9-14)34(29,30)18-12-23-22(25-20(18)27)33-13-19(26)24-17-7-5-4-6-16(17)21(28)31-2/h4-12H,3,13H2,1-2H3,(H,24,26)(H,23,25,27)InChIKey
HOGIYVUUDOWZCV-UHFFFAOYSA-NSynonyms
1223848-56-31223848563
CCOC1=CC=C(C=C1)S(=O)(=O)C2=CN=C(NC2=O)SCC(=O)NC3=CC=CC=C3C(=O)OC
CCOc1ccc(cc1)S(=O)(=O)c1cnc((nH)c1=O)SCC(=O)Nc1ccccc1C(=O)OC
InChI=1SC22H21N3O7S2c13321481015(11914)34(2930)18122322(2520(18)27)331319(26)2417754616(17)21(28)312h412H313H212H3(H2426)(H232527)
methyl2((((5((4ethoxyphenyl)sulfonyl)6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((5(4ethoxyphenyl)sulfonyl6oxo1Hpyrimidin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2(2((5((4ETHOXYPHENYL)SULFONYL)6OXO16DIHYDROPYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
MFCD20755080
ZINC000046016444
ZINC46016444
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