Vitas-M small molecule compound
2-(butylsulfanyl)-3-(prop-2-en-1-yl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK993877
SMILES CCCCSc1nc2sc3c(c2c(=O)n1CC=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 C18H24N2OS2 MW 348.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2OS2/c1-3-5-12-22-18-19-16-15(17(21)20(18)11-4-2)13-9-7-6-8-10-14(13)23-16/h4H,2-3,5-12H2,1H3InChIKey
MYAQWWQTJVDIHN-UHFFFAOYSA-NSynonyms
2(butylsulfanyl)3(prop2en1yl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2butylsulfanyl3prop2enyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CCCCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1CC=C
InChI=1SC18H24N2OS2c135122218191615(17(21)20(18)1142)1397681014(13)2316h4H23512H21H3
MFCD02631033
ZINC000032604649
ZINC32604649
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