Vitas-M small molecule compound
ethyl 6-benzyl-2-[({[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Catalog ID
STK678824
SMILES CCOC(=O)c1c(NC(=O)CSc2nnnn2c2ccc(cc2)OC)sc2c1CCN(C2)Cc1ccccc1
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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 C27H28N6O4S2 MW 564.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6O4S2/c1-3-37-26(35)24-21-13-14-32(15-18-7-5-4-6-8-18)16-22(21)39-25(24)28-23(34)17-38-27-29-30-31-33(27)19-9-11-20(36-2)12-10-19/h4-12H,3,13-17H2,1-2H3,(H,28,34)InChIKey
OFAKWTNNDBRSJX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=O)CSC4=NN=NN4C5=CC=C(C=C5)OC
ethyl6benzyl2((((1(4methoxyphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)4567tetrahydrothieno(23c)pyridine3carboxylate
ETHYL6BENZYL2((2(1(4METHOXYPHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE3CARBOXYLATE
InChI=1SC27H28N6O4S2c133726(35)2421131432(15187546818)1622(21)3925(24)2823(34)17382729303133(27)1991120(362)121019h412H31317H212H3(H2834)
MFCD03308326
ZINC000033354854
ZINC33354854
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