Vitas-M small molecule compound
2-({(E)-[4-(benzyloxy)-3-ethoxyphenyl]methylidene}amino)-N-cyclohexyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL506472
SMILES CCOc1cc(ccc1OCc1ccccc1)/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 C31H36N2O3S MW 516.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O3S/c1-2-35-27-19-23(17-18-26(27)36-21-22-11-5-3-6-12-22)20-32-31-29(25-15-9-10-16-28(25)37-31)30(34)33-24-13-7-4-8-14-24/h3,5-6,11-12,17-20,24H,2,4,7-10,13-16,21H2,1H3,(H,33,34)/b32-20+InChIKey
DVVYVXLQYWAAGB-UZWMFBFFSA-NSynonyms
~(N)cyclohexyl2((~(E))(3ethoxy4phenylmethoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
2(((E)(4(benzyloxy)3ethoxyphenyl)methylidene)amino)Ncyclohexyl4567tetrahydro1benzothiophene3carboxamide
9688798
InChI=1SC31H36N2O3Sc1235271923(171826(27)362122115361222)20323129(25159101628(25)3731)30(34)3324137481424h3561112172024H24710131621H21H3(H3334)b3220+
MFCD05149884
ZINC000018158531
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