Vitas-M small molecule compound
2-{[(E)-{3-methoxy-4-[2-(morpholin-4-yl)-2-oxoethoxy]phenyl}methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL376369
SMILES COc1cc(ccc1OCC(=O)N1CCOCC1)/C=N/c1sc2c(c1C(=O)N)CCCC2
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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 C23H27N3O5S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5S/c1-29-18-12-15(6-7-17(18)31-14-20(27)26-8-10-30-11-9-26)13-25-23-21(22(24)28)16-4-2-3-5-19(16)32-23/h6-7,12-13H,2-5,8-11,14H2,1H3,(H2,24,28)/b25-13+InChIKey
NAGVDWOUZWJPDP-DHRITJCHSA-NSynonyms
2(((E)(3methoxy4(2(morpholin4yl)2oxoethoxy)phenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
2((E)(3methoxy4(2morpholin4yl2oxoethoxy)phenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
COC1=C(C=CC(=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)N)OCC(=O)N4CCOCC4
COc1cc(ccc1OCC(=O)N1CCOCC1)C=Nc1sc2c(c1C(=O)N)CCCC2
InChI=1SC23H27N3O5Sc129181215(6717(18)311420(27)268103011926)13252321(22(24)28)16423519(16)3223h671213H2581114H21H3(H22428)b2513+
MFCD05134634
ZINC000001107626
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