Vitas-M small molecule compound
methyl 2-[({[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL085044
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2c3ccccc3oc2c(=O)n1CC1CCCO1
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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 C25H23N3O6S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6S/c1-32-24(31)16-8-2-4-10-18(16)26-20(29)14-35-25-27-21-17-9-3-5-11-19(17)34-22(21)23(30)28(25)13-15-7-6-12-33-15/h2-5,8-11,15H,6-7,12-14H2,1H3,(H,26,29)InChIKey
QBDUTYVLNYCYFN-UHFFFAOYSA-NSynonyms
899941-98-1899941981
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC25H23N3O6Sc13224(31)168241018(16)2620(29)1435252721179351119(17)3422(21)23(30)28(25)131576123315h2581115H671214H21H3(H2629)
methyl2((((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2(2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
MFCD07650723
ZINC000009750670
ZINC000009750679
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