Vitas-M small molecule compound
2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL337621
SMILES CCCOc1ccc(cc1)/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 C28H28N4O3S2 MW 532.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O3S2/c1-2-16-35-21-14-12-19(13-15-21)17-29-31-24(33)18-36-28-30-26-25(22-10-6-7-11-23(22)37-26)27(34)32(28)20-8-4-3-5-9-20/h3-5,8-9,12-15,17H,2,6-7,10-11,16,18H2,1H3,(H,31,33)/b29-17+InChIKey
IDFMXLHCZFGKRC-STBIYBPSSA-NSynonyms
612825-98-6(E)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(4propoxybenzylidene)acetohydrazide
2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N((E)(4propoxyphenyl)methylidene)acetohydrazide
2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((E)(4propoxyphenyl)methylideneamino)acetamide
612825986
CCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
CCCOc1ccc(cc1)C=NNC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3
InChI=1SC28H28N4O3S2c12163521141219(131521)17293124(33)183628302625(2210671123(22)3726)27(34)32(28)208435920h3589121517H26710111618H21H3(H3133)b2917+
MFCD03222407
ZINC000002222425
ZINC101361938
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