Vitas-M small molecule compound
N-(4-methylbenzyl)-2-({4-oxo-3-[3-(propan-2-yloxy)propyl]-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
Catalog ID
STL085189
SMILES O=C(NCc1ccc(cc1)C)CSc1nc2c3ccccc3oc2c(=O)n1CCCOC(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 C26H29N3O4S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4S/c1-17(2)32-14-6-13-29-25(31)24-23(20-7-4-5-8-21(20)33-24)28-26(29)34-16-22(30)27-15-19-11-9-18(3)10-12-19/h4-5,7-12,17H,6,13-16H2,1-3H3,(H,27,30)InChIKey
SJEYYPXFNYRKMA-UHFFFAOYSA-NSynonyms
900004-40-22((3(3ISOPROPOXYPROPYL)4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)N(4METHYLBENZYL)ACETAMIDE
900004402
CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2CCCOC(C)C)OC4=CC=CC=C43
InChI=1SC26H29N3O4Sc117(2)32146132925(31)2423(20745821(20)3324)2826(29)341622(30)27151911918(3)101219h4571217H61316H213H3(H2730)
MFCD07650893
N((4methylphenyl)methyl)2((4oxo3(3propan2yloxypropyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(4methylbenzyl)2((4oxo3(3(propan2yloxy)propyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009752079
ZINC09752079
ZINC9752079
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