Vitas-M small molecule compound
3-(2-methylphenyl)-2-sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK439701
SMILES Sc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCCCCC3
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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 C19H20N2OS2 MW 356.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2OS2/c1-12-8-6-7-10-14(12)21-18(22)16-13-9-4-2-3-5-11-15(13)24-17(16)20-19(21)23/h6-8,10H,2-5,9,11H2,1H3,(H,20,23)InChIKey
KPXPUHKLCKQDJZ-UHFFFAOYSA-NSynonyms
3(2methylphenyl)2sulfanyl5678910hexahydrocycloocta(45)thieno(23d)pyrimidin4(3H)one
3(2methylphenyl)2sulfanylidene5678910hexahydro1Hcycloocta(23)thieno(24b)pyrimidin4one
CC1=CC=CC=C1N2C(=O)C3=C(NC2=S)SC4=C3CCCCCC4
InChI=1SC19H20N2OS2c1128671014(12)2118(22)1613942351115(13)2417(16)2019(21)23h6810H25911H21H3(H2023)
MFCD03945912
ZINC000017073708
ZINC17073708
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