Vitas-M small molecule compound
methyl 4-({[1-(1,1-dioxidotetrahydrothiophen-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazin-3-yl]carbonyl}amino)benzoate
Catalog ID
STL233577
SMILES COC(=O)c1ccc(cc1)NC(=O)C1=NN(C(=O)CC1)C1CCS(=O)(=O)C1
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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 C17H19N3O6S MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O6S/c1-26-17(23)11-2-4-12(5-3-11)18-16(22)14-6-7-15(21)20(19-14)13-8-9-27(24,25)10-13/h2-5,13H,6-10H2,1H3,(H,18,22)InChIKey
SNVSRKFNEFIYMK-UHFFFAOYSA-NSynonyms
950036-26-7950036267
COC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3
InChI=1SC17H19N3O6Sc12617(23)112412(5311)1816(22)146715(21)20(1914)138927(2425)1013h2513H610H21H3(H1822)
methyl4(((1(11dioxidotetrahydrothiophen3yl)6oxo1456tetrahydropyridazin3yl)carbonyl)amino)benzoate
methyl4((1(11dioxothiolan3yl)6oxo45dihydropyridazine3carbonyl)amino)benzoate
methyl4(1(11dioxidotetrahydrothiophen3yl)6oxo1456tetrahydropyridazine3carboxamido)benzoate
MFCD07949476
ZINC000012809926
ZINC000012809931
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