Vitas-M small molecule compound
N'-{(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
Catalog ID
STL407151
SMILES COc1ccc(cc1OCc1ccccc1)/C=N/NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3
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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 C33H30N4O4S2 MW 610.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N4O4S2/c1-40-26-17-16-23(18-27(26)41-20-22-10-4-2-5-11-22)19-34-36-29(38)21-42-33-35-31-30(25-14-8-9-15-28(25)43-31)32(39)37(33)24-12-6-3-7-13-24/h2-7,10-13,16-19H,8-9,14-15,20-21H2,1H3,(H,36,38)/b34-19+InChIKey
PFAUEVDDXWWIIX-ALQBTCKLSA-NSynonyms
(E)N(3(benzyloxy)4methoxybenzylidene)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
COC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5)OCC6=CC=CC=C6
COc1ccc(cc1OCc1ccccc1)C=NNC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3
InChI=1SC33H30N4O4S2c14026171623(1827(26)412022104251122)19343629(38)214233353130(2514891528(25)4331)32(39)37(33)24126371324h2710131619H8914152021H21H3(H3638)b3419+
MFCD03222339
N((E)(3(benzyloxy)4methoxyphenyl)methylidene)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
N((E)(4methoxy3phenylmethoxyphenyl)methylideneamino)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000100974130
ZINC104543194
Check stock
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Check stock on Vitas-MAvailable files
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