Vitas-M small molecule compound
6-benzyl-2-[4-methoxy-3-(phenoxymethyl)phenyl]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK438996
SMILES COc1ccc(cc1COc1ccccc1)c1[nH]c(=O)c2c(n1)sc(c2)Cc1ccccc1
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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 C27H22N2O3S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O3S/c1-31-24-13-12-19(15-20(24)17-32-21-10-6-3-7-11-21)25-28-26(30)23-16-22(33-27(23)29-25)14-18-8-4-2-5-9-18/h2-13,15-16H,14,17H2,1H3,(H,28,29,30)InChIKey
CNGKUVDITWJIDZ-UHFFFAOYSA-NSynonyms
2(4METHOXY3(PHENOXYMETHYL)PHENYL)6BENZYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE
6BENZYL2(4METHOXY3(PHENOXYMETHYL)PHENYL)3HTHIENO(23D)PYRIMIDIN4ONE
6benzyl2(4methoxy3(phenoxymethyl)phenyl)thieno(23d)pyrimidin4(3H)one
COC1=C(C=C(C=C1)C2=NC3=C(C=C(S3)CC4=CC=CC=C4)C(=O)N2)COC5=CC=CC=C5
COc1ccc(cc1COc1ccccc1)c1(nH)c(=O)c2c(n1)sc(c2)Cc1ccccc1
InChI=1SC27H22N2O3Sc13124131219(1520(24)173221106371121)252826(30)231622(3327(23)2925)14188425918h2131516H1417H21H3(H282930)
MFCD03945861
ZINC000020258635
ZINC20258635
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