Vitas-M small molecule compound
2-[(2-chloro-6-fluorobenzyl)sulfanyl]-3-pentylthieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL125699
SMILES CCCCCn1c(SCc2c(F)cccc2Cl)nc2c(c1=O)scc2
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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 C18H18ClFN2OS2 MW 396.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClFN2OS2/c1-2-3-4-9-22-17(23)16-15(8-10-24-16)21-18(22)25-11-12-13(19)6-5-7-14(12)20/h5-8,10H,2-4,9,11H2,1H3InChIKey
XCSDLAJGHSBDBF-UHFFFAOYSA-NSynonyms
2((2chloro6fluorobenzyl)sulfanyl)3pentylthieno(32d)pyrimidin4(3H)one
2((2chloro6fluorophenyl)methylsulfanyl)3pentylthieno(32d)pyrimidin4one
CCCCCN1C(=O)C2=C(C=CS2)N=C1SCC3=C(C=CC=C3Cl)F
InChI=1SC18H18ClFN2OS2c123492217(23)1615(8102416)2118(22)25111213(19)65714(12)20h5810H24911H21H3
MFCD20738121
ZINC000067259680
ZINC67259680
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