Vitas-M small molecule compound
2-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK016255
SMILES COc1cc(ccc1OCc1ccccc1Cl)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C24H21ClN2O3S MW 452.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O3S/c1-29-19-12-14(10-11-18(19)30-13-15-6-2-4-8-17(15)25)22-26-23(28)21-16-7-3-5-9-20(16)31-24(21)27-22/h2,4,6,8,10-12H,3,5,7,9,13H2,1H3,(H,26,27,28)InChIKey
HPOXZPGLLNWTKO-UHFFFAOYSA-NSynonyms
2(4((2chlorobenzyl)oxy)3methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4((2chlorophenyl)methoxy)3methoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
COC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OCC5=CC=CC=C5Cl
COc1cc(ccc1OCc1ccccc1Cl)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC24H21ClN2O3Sc129191214(101118(19)301315624817(15)25)222623(28)2116735920(16)3124(21)2722h24681012H357913H21H3(H262728)
MFCD02297165
STK016255
ZINC000002991327
ZINC02991327
ZINC2991327
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