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)-(3-phenoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK722876
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)N/N=C/c1cccc(c1)Oc1ccccc1
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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 C31H26N4O3S2 MW 566.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O3S2/c36-27(34-32-19-21-10-9-15-24(18-21)38-23-13-5-2-6-14-23)20-39-31-33-29-28(25-16-7-8-17-26(25)40-29)30(37)35(31)22-11-3-1-4-12-22/h1-6,9-15,18-19H,7-8,16-17,20H2,(H,34,36)/b32-19+InChIKey
SMWBBMUYAAFKAN-BIZUNTBRSA-NSynonyms
(E)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(3phenoxybenzylidene)acetohydrazide
2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N((E)(3phenoxyphenyl)methylidene)acetohydrazide
2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((E)(3phenoxyphenyl)methylideneamino)acetamide
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NN=CC5=CC(=CC=C5)OC6=CC=CC=C6
InChI=1SC31H26N4O3S2c3627(343219211091524(1821)3823135261423)203931332928(2516781726(25)4029)30(37)35(31)22113141222h169151819H78161720H2(H3436)b3219+
MFCD03222343
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)NN=Cc1cccc(c1)Oc1ccccc1
ZINC000001876690
ZINC102642181
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