Vitas-M small molecule compound
N-(4-methylbenzyl)-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093945
SMILES CC(CCn1c(SCC(=O)NCc2ccc(cc2)C)nc2c(c1=O)oc1c2cccc1)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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-16(2)12-13-28-24(30)23-22(19-6-4-5-7-20(19)31-23)27-25(28)32-15-21(29)26-14-18-10-8-17(3)9-11-18/h4-11,16H,12-15H2,1-3H3,(H,26,29)InChIKey
SEKBHQHPJVRDGF-UHFFFAOYSA-NSynonyms
900003-56-72((3(3methylbutyl)4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N((4methylphenyl)methyl)acetamide
2((3ISOPENTYL4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)N(4METHYLBENZYL)ACETAMIDE
900003567
CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2CCC(C)C)OC4=CC=CC=C43
InChI=1SC25H27N3O3Sc116(2)12132824(30)2322(19645720(19)3123)2725(28)321521(29)26141810817(3)91118h41116H1215H213H3(H2629)
MFCD07650796
N(4methylbenzyl)2((3(3methylbutyl)4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009751506
ZINC09751506
ZINC9751506
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