Vitas-M small molecule compound
methyl 4-cyano-5-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-3-methylthiophene-2-carboxylate
Catalog ID
STK457049
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)c1cc(nc2c1cccc2)c1ccc(c(c1)C)C
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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 C26H21N3O3S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O3S/c1-14-9-10-17(11-15(14)2)22-12-19(18-7-5-6-8-21(18)28-22)24(30)29-25-20(13-27)16(3)23(33-25)26(31)32-4/h5-12H,1-4H3,(H,29,30)InChIKey
HHMRILWTIGPDGJ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C(=O)OC)C)C#N)C
InChI=1SC26H21N3O3Sc11491017(1115(14)2)221219(18756821(18)2822)24(30)292520(1327)16(3)23(3325)26(31)324h512H14H3(H2930)
methyl4cyano5(((2(34dimethylphenyl)quinolin4yl)carbonyl)amino)3methylthiophene2carboxylate
METHYL4CYANO5((2(34DIMETHYLPHENYL)QUINOLINE4CARBONYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
METHYL5((2(34DIMETHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
MFCD01342211
ZINC000020395099
ZINC20395099
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