Vitas-M small molecule compound
methyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-(2-iodophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK700514
SMILES CCOC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1I
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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 C18H17IN2O5S MW 500.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17IN2O5S/c1-3-26-13(22)9-27-17-11(8-20)14(10-6-4-5-7-12(10)19)15(16(23)21-17)18(24)25-2/h4-7,14-15H,3,9H2,1-2H3,(H,21,23)InChIKey
MJAXWZKFQKEIAT-UHFFFAOYSA-NSynonyms
369607-72-7369607727
CCOC(=O)CSC1=C(C(C(C(=O)N1)C(=O)OC)C2=CC=CC=C2I)C#N
InChI=1SC18H17IN2O5Sc132613(22)9271711(820)14(10645712(10)19)15(16(23)2117)18(24)252h471415H39H212H3(H2123)
methyl5cyano6((2ethoxy2oxoethyl)sulfanyl)4(2iodophenyl)2oxo1234tetrahydropyridine3carboxylate
methyl5cyano6((2ethoxy2oxoethyl)thio)4(2iodophenyl)2oxo1234tetrahydropyridine3carboxylate
METHYL5CYANO6(2ETHOXY2OXOETHYL)SULFANYL4(2IODOPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD01556860
ZINC000008973552
ZINC000017029222
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