Vitas-M small molecule compound
methyl 5-{[(6-chloro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-4-cyano-3-methylthiophene-2-carboxylate
Catalog ID
STK454461
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)c1cc2cc(Cl)ccc2oc1=O
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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 C18H11ClN2O5S MW 402.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11ClN2O5S/c1-8-12(7-20)16(27-14(8)18(24)25-2)21-15(22)11-6-9-5-10(19)3-4-13(9)26-17(11)23/h3-6H,1-2H3,(H,21,22)InChIKey
FCKIAKHFQVKOKB-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2=O)C(=O)OC
InChI=1SC18H11ClN2O5Sc1812(720)16(2714(8)18(24)252)2115(22)1169510(19)3413(9)2617(11)23h36H12H3(H2122)
methyl5(((6chloro2oxo2Hchromen3yl)carbonyl)amino)4cyano3methylthiophene2carboxylate
METHYL5((6CHLORO2OXOCHROMEN3YL)CARBONYLAMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
methyl5((6chloro2oxochromene3carbonyl)amino)4cyano3methylthiophene2carboxylate
MFCD04226831
ZINC000017082557
ZINC17082557
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