Vitas-M small molecule compound
N-(2,3-dihydro-1H-inden-5-yl)-2-{[3-(3,4-dimethylbenzyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL029790
SMILES O=C(Nc1ccc2c(c1)CCC2)CSc1nc2ccsc2c(=O)n1Cc1ccc(c(c1)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 C26H25N3O2S2 MW 475.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S2/c1-16-6-7-18(12-17(16)2)14-29-25(31)24-22(10-11-32-24)28-26(29)33-15-23(30)27-21-9-8-19-4-3-5-20(19)13-21/h6-13H,3-5,14-15H2,1-2H3,(H,27,30)InChIKey
KJCDSQABNCTOQT-UHFFFAOYSA-NSynonyms
1252918-34-51252918345
CC1=C(C=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4=CC5=C(CCC5)C=C4)C
InChI=1SC26H25N3O2S2c1166718(1217(16)2)142925(31)2422(10113224)2826(29)331523(30)2721981943520(19)1321h613H351415H212H3(H2730)
MFCD18190080
N(23dihydro1Hinden5yl)2((3(34dimethylbenzyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(23dihydro1Hinden5yl)2(3((34dimethylphenyl)methyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000067690020
ZINC67690020
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