Vitas-M small molecule compound
methyl 2-({[(3-methyl-4-oxo-7-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL193125
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2c(c[nH]c2c(=O)n1C)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 C23H20N4O4S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S/c1-27-21(29)20-19(16(12-24-20)14-8-4-3-5-9-14)26-23(27)32-13-18(28)25-17-11-7-6-10-15(17)22(30)31-2/h3-12,24H,13H2,1-2H3,(H,25,28)InChIKey
HFDHWQPATJBLBY-UHFFFAOYSA-NSynonyms
1040638-94-51040638945
CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)NC4=CC=CC=C4C(=O)OC
COC(=O)c1ccccc1NC(=O)CSc1nc2c(c(nH)c2c(=O)n1C)c1ccccc1
InChI=1SC23H20N4O4Sc12721(29)2019(16(122420)148435914)2623(27)321318(28)251711761015(17)22(30)312h31224H13H212H3(H2528)
methyl2((((3methyl4oxo7phenyl45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((3methyl4oxo7phenyl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2(2((3METHYL4OXO7PHENYL45DIHYDRO3HPYRROLO(32D)PYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
MFCD11995399
ZINC000016840896
ZINC16840896
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