Vitas-M small molecule compound
2-{[(Z)-{3-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}methylidene]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL506464
SMILES CCOc1cc(ccc1OCc1ccccc1F)/C=N\c1sc2c(c1C(=O)Nc1ccccc1)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 C31H29FN2O3S MW 528.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29FN2O3S/c1-2-36-27-18-21(16-17-26(27)37-20-22-10-6-8-14-25(22)32)19-33-31-29(24-13-7-9-15-28(24)38-31)30(35)34-23-11-4-3-5-12-23/h3-6,8,10-12,14,16-19H,2,7,9,13,15,20H2,1H3,(H,34,35)/b33-19-InChIKey
PJKIGTPVAUOFLX-APTWKGOFSA-NSynonyms
2(((Z)(3ethoxy4((2fluorobenzyl)oxy)phenyl)methylidene)amino)Nphenyl4567tetrahydro1benzothiophene3carboxamide
2((~(Z))(3ethoxy4((2fluorophenyl)methoxy)phenyl)methylideneamino)~(N)phenyl4567tetrahydro1benzothiophene3carboxamide
6244493
InChI=1SC31H29FN2O3Sc1236271821(161726(27)37202210681425(22)32)19333129(2413791528(24)3831)30(35)3423114351223h3681012141619H279131520H21H3(H3435)b3319
MFCD03548507
ZINC000016689281
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