Vitas-M small molecule compound
propyl 2-{[(6-chloro-2-phenylquinolin-4-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK434281
SMILES CCCOC(=O)c1c(NC(=O)c2cc(nc3c2cc(Cl)cc3)c2ccccc2)sc2c1CCC(C2)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 C29H27ClN2O3S MW 519.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O3S/c1-3-13-35-29(34)26-20-11-9-17(2)14-25(20)36-28(26)32-27(33)22-16-24(18-7-5-4-6-8-18)31-23-12-10-19(30)15-21(22)23/h4-8,10,12,15-17H,3,9,11,13-14H2,1-2H3,(H,32,33)InChIKey
GMUHSDWRQKWJOU-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC29H27ClN2O3Sc13133529(34)262011917(2)1425(20)3628(26)3227(33)221624(187546818)3123121019(30)1521(22)23h4810121517H39111314H212H3(H3233)
MFCD03942593
propyl2(((6chloro2phenylquinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propyl2((6chloro2phenylquinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000020562520
ZINC000020562523
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