Vitas-M small molecule compound
N'-{(E)-[4-(dimethylamino)phenyl]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
STL307943
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)N/N=C/c1ccc(cc1)N(C)C
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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 C27H27N5O2S2 MW 517.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O2S2/c1-31(2)19-14-12-18(13-15-19)16-28-30-23(33)17-35-27-29-25-24(21-10-6-7-11-22(21)36-25)26(34)32(27)20-8-4-3-5-9-20/h3-5,8-9,12-16H,6-7,10-11,17H2,1-2H3,(H,30,33)/b28-16+InChIKey
KLSOLGRSGCTFMK-LQKURTRISA-NSynonyms
497168-44-2(E)N(4(dimethylamino)benzylidene)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
497168442
CN(C)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC27H27N5O2S2c131(2)19141218(131519)16283023(33)173527292524(2110671122(21)3625)26(34)32(27)208435920h35891216H67101117H212H3(H3033)b2816+
MFCD03222348
N((E)(4(dimethylamino)phenyl)methylidene)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
N((E)(4(dimethylamino)phenyl)methylideneamino)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)NN=Cc1ccc(cc1)N(C)C
ZINC000002225707
ZINC33350963
Check stock
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Check stock on Vitas-MAvailable files
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