Vitas-M small molecule compound
N-(4-methylbenzyl)-2-{[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL085064
SMILES O=C(NCc1ccc(cc1)C)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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-16-8-10-17(11-9-16)13-26-21(29)15-33-25-27-22-19-6-2-3-7-20(19)32-23(22)24(30)28(25)14-18-5-4-12-31-18/h2-3,6-11,18H,4-5,12-15H2,1H3,(H,26,29)InChIKey
WRBARLYBVIFNMT-UHFFFAOYSA-NSynonyms
899942-06-4899942064
CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC25H25N3O4Sc11681017(11916)132621(29)153325272219623720(19)3223(22)24(30)28(25)141854123118h2361118H451215H21H3(H2629)
MFCD07650742
N((4methylphenyl)methyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(4METHYLBENZYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(4methylbenzyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009751044
ZINC000009751059
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