Vitas-M small molecule compound
3-(4-bromophenyl)-2-[(2,4,6-trimethylbenzyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL143320
SMILES Cc1cc(C)c(c(c1)C)CSc1nc2ccsc2c(=O)n1c1ccc(cc1)Br
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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 C22H19BrN2OS2 MW 471.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2OS2/c1-13-10-14(2)18(15(3)11-13)12-28-22-24-19-8-9-27-20(19)21(26)25(22)17-6-4-16(23)5-7-17/h4-11H,12H2,1-3H3InChIKey
CJOCKCQMBPRSKE-UHFFFAOYSA-NSynonyms
3(4bromophenyl)2((246trimethylbenzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(4bromophenyl)2((246trimethylphenyl)methylsulfanyl)thieno(32d)pyrimidin4one
CC1=CC(=C(C(=C1)C)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Br)SC=C3)C
InChI=1SC22H19BrN2OS2c1131014(2)18(15(3)1113)1228222419892720(19)21(26)25(22)176416(23)5717h411H12H213H3
MFCD20749106
ZINC000071327541
ZINC71327541
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