Vitas-M small molecule compound
2-{[3-(3-methoxybenzyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Catalog ID
STL084964
SMILES COc1cccc(c1)Cn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)oc1c2cccc1
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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 C28H25N3O4S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4S/c1-34-21-11-7-10-20(16-21)17-31-27(33)26-25(22-12-5-6-13-23(22)35-26)30-28(31)36-18-24(32)29-15-14-19-8-3-2-4-9-19/h2-13,16H,14-15,17-18H2,1H3,(H,29,32)InChIKey
OAGQGIKFANSFJQ-UHFFFAOYSA-NSynonyms
899754-56-42((3((3methoxyphenyl)methyl)4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(2phenylethyl)acetamide
2((3(3methoxybenzyl)4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(2phenylethyl)acetamide
2((3(3METHOXYBENZYL)4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)NPHENETHYLACETAMIDE
899754564
COC1=CC=CC(=C1)CN2C(=O)C3=C(C4=CC=CC=C4O3)N=C2SCC(=O)NCCC5=CC=CC=C5
InChI=1SC28H25N3O4Sc134211171020(1621)173127(33)2625(2212561323(22)3526)3028(31)361824(32)291514198324919h21316H14151718H21H3(H2932)
MFCD07650657
ZINC000009749805
ZINC09749805
ZINC9749805
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