Vitas-M small molecule compound
N'-[(E)-(2-methoxynaphthalen-1-yl)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
STK722884
SMILES COc1ccc2c(c1/C=N/NC(=O)CSc1nc3sc4c(c3c(=O)n1c1ccccc1)CCCC4)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 C30H26N4O3S2 MW 554.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O3S2/c1-37-24-16-15-19-9-5-6-12-21(19)23(24)17-31-33-26(35)18-38-30-32-28-27(22-13-7-8-14-25(22)39-28)29(36)34(30)20-10-3-2-4-11-20/h2-6,9-12,15-17H,7-8,13-14,18H2,1H3,(H,33,35)/b31-17+InChIKey
VEHFOARGBWNJTK-KBVAKVRCSA-NSynonyms
(E)N((2methoxynaphthalen1yl)methylene)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
COC1=C(C2=CC=CC=C2C=C1)C=NNC(=O)CSC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3C6=CC=CC=C6
COc1ccc2c(c1C=NNC(=O)CSc1nc3sc4c(c3c(=O)n1c1ccccc1)CCCC4)cccc2
InChI=1SC30H26N4O3S2c137241615199561221(19)23(24)17313326(35)183830322827(2213781425(22)3928)29(36)34(30)20103241120h269121517H78131418H21H3(H3335)b3117+
MFCD03217630
N((E)(2methoxynaphthalen1yl)methylidene)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
N((E)(2methoxynaphthalen1yl)methylideneamino)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000001882213
ZINC102642201
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