Vitas-M small molecule compound
3-(4-methylphenyl)-2-(methylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831036
SMILES CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCCC3
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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/c1-12-8-10-13(11-9-12)21-18(22)16-14-6-4-3-5-7-15(14)24-17(16)20-19(21)23-2/h8-11H,3-7H2,1-2H3InChIKey
RXNZNVVGQKBILZ-UHFFFAOYSA-NSynonyms
351160-97-92(methylthio)3(ptolyl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(4methylphenyl)2(methylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methylphenyl)2methylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351160979
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=C3CCCCC4
InChI=1SC19H20N2OS2c11281013(11912)2118(22)16146435715(14)2417(16)2019(21)232h811H37H212H3
MFCD01879147
ZINC000002274794
ZINC02274794
ZINC2274794
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