Vitas-M small molecule compound
2-[(4-tert-butylbenzyl)sulfanyl]-3-pentylthieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL125684
SMILES CCCCCn1c(SCc2ccc(cc2)C(C)(C)C)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 C22H28N2OS2 MW 400.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2OS2/c1-5-6-7-13-24-20(25)19-18(12-14-26-19)23-21(24)27-15-16-8-10-17(11-9-16)22(2,3)4/h8-12,14H,5-7,13,15H2,1-4H3InChIKey
QTRCCZFMQYFEKF-UHFFFAOYSA-NSynonyms
2((4tertbutylbenzyl)sulfanyl)3pentylthieno(32d)pyrimidin4(3H)one
2((4tertbutylphenyl)methylsulfanyl)3pentylthieno(32d)pyrimidin4one
CCCCCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=C(C=C3)C(C)(C)C
InChI=1SC22H28N2OS2c1567132420(25)1918(12142619)2321(24)27151681017(11916)22(23)4h81214H571315H214H3
MFCD20738105
ZINC000067259655
ZINC67259655
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