Vitas-M small molecule compound

ethyl 2-[({[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK548257
SMILES CCOC(=O)c1c(NC(=O)CSc2nc3CCN(Cc3c(c2C#N)c2cccs2)C)sc2c1CCCC2

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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 C27H28N4O3S3 MW 552.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S3/c1-3-34-27(33)24-16-7-4-5-8-20(16)37-26(24)30-22(32)15-36-25-17(13-28)23(21-9-6-12-35-21)18-14-31(2)11-10-19(18)29-25/h6,9,12H,3-5,7-8,10-11,14-15H2,1-2H3,(H,30,32)
InChIKey
GLBIRVVZGXTCIJ-UHFFFAOYSA-N
Synonyms
445383-33-5
445383335
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC4=C(CN(CC4)C)C(=C3C#N)C5=CC=CS5
ethyl2((((3cyano6methyl4(thiophen2yl)5678tetrahydro16naphthyridin2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((3cyano6methyl4thiophen2yl78dihydro5H16naphthyridin2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(2((3cyano6methyl4(thiophen2yl)5678tetrahydro16naphthyridin2yl)thio)acetamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC27H28N4O3S3c133427(33)2416745820(16)3726(24)3022(32)15362517(1328)23(2196123521)181431(2)111019(18)2925h6912H357810111415H212H3(H3032)
MFCD03270471
ZINC000033353778
ZINC33353778

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Available files

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