Vitas-M small molecule compound
3,7-dimethyl-2-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK734929
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(n1)SCc1nc2ccccc2nc1C)C
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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 C22H22N4OS2 MW 422.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS2/c1-12-8-9-14-18(10-12)29-20-19(14)21(27)26(3)22(25-20)28-11-17-13(2)23-15-6-4-5-7-16(15)24-17/h4-7,12H,8-11H2,1-3H3InChIKey
RGJAFDUJEYIZDO-UHFFFAOYSA-NSynonyms
37dimethyl2(((3methylquinoxalin2yl)methyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
37dimethyl2((3methylquinoxalin2yl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=NC5=CC=CC=C5N=C4C)C
InChI=1SC22H22N4OS2c112891418(1012)292019(14)21(27)26(3)22(2520)28111713(2)2315645716(15)2417h4712H811H213H3
MFCD03854888
ZINC000001059566
ZINC000001059567
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