Vitas-M small molecule compound
N-(4-methoxybenzyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093948
SMILES COc1ccc(cc1)CNC(=O)CSc1nc2c3ccccc3oc2c(=O)n1CCC(C)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 C25H27N3O4S MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S/c1-16(2)12-13-28-24(30)23-22(19-6-4-5-7-20(19)32-23)27-25(28)33-15-21(29)26-14-17-8-10-18(31-3)11-9-17/h4-11,16H,12-15H2,1-3H3,(H,26,29)InChIKey
BXXKVDGYTABMDQ-UHFFFAOYSA-NSynonyms
899961-37-62((3ISOPENTYL4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)N(4METHOXYBENZYL)ACETAMIDE
899961376
CC(C)CCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NCC4=CC=C(C=C4)OC
InChI=1SC25H27N3O4Sc116(2)12132824(30)2322(19645720(19)3223)2725(28)331521(29)26141781018(313)11917h41116H1215H213H3(H2629)
MFCD07650800
N((4methoxyphenyl)methyl)2((3(3methylbutyl)4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(4methoxybenzyl)2((3(3methylbutyl)4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009751538
ZINC09751538
ZINC9751538
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