Vitas-M small molecule compound
3-butyl-2-(methylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK722401
SMILES CCCCn1c(SC)nc2c(c1=O)c1CCCCCc1s2
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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 C16H22N2OS2 MW 322.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2OS2/c1-3-4-10-18-15(19)13-11-8-6-5-7-9-12(11)21-14(13)17-16(18)20-2/h3-10H2,1-2H3InChIKey
DFBYFLJUEVFSAP-UHFFFAOYSA-NSynonyms
351004-92-7351004927
3butyl2(methylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3butyl2(methylthio)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3butyl2methylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CCCCN1C(=O)C2=C(N=C1SC)SC3=C2CCCCC3
InChI=1SC16H22N2OS2c134101815(19)13118657912(11)2114(13)1716(18)202h310H212H3
MFCD01957518
ZINC000003902145
ZINC03902145
ZINC3902145
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