Vitas-M small molecule compound
methyl 2-[({[4-methyl-5-(2-phenylquinolin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK439867
SMILES COC(=O)c1ccsc1NC(=O)CSc1nnc(n1C)c1cc(nc2c1cccc2)c1ccccc1
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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 C26H21N5O3S2 MW 515.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O3S2/c1-31-23(19-14-21(16-8-4-3-5-9-16)27-20-11-7-6-10-17(19)20)29-30-26(31)36-15-22(32)28-24-18(12-13-35-24)25(33)34-2/h3-14H,15H2,1-2H3,(H,28,32)InChIKey
DBYMNEJYJKRXBI-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=C(C=CS2)C(=O)OC)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5
InChI=1SC26H21N5O3S2c13123(191421(168435916)272011761017(19)20)293026(31)361522(32)282418(12133524)25(33)342h314H15H212H3(H2832)
methyl2((((4methyl5(2phenylquinolin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
METHYL2((2((4METHYL5(2PHENYLQUINOLIN4YL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL2(2(4METHYL5(2PHENYL(4QUINOLYL))124TRIAZOL3YLTHIO)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03946058
ZINC000020427631
ZINC20427631
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