Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-{[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL085034
SMILES O=C(Nc1ccc(c(c1)C)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/c1-15-9-10-17(12-16(15)2)26-21(29)14-33-25-27-22-19-7-3-4-8-20(19)32-23(22)24(30)28(25)13-18-6-5-11-31-18/h3-4,7-10,12,18H,5-6,11,13-14H2,1-2H3,(H,26,29)InChIKey
HSPABRUQFSULMG-UHFFFAOYSA-NSynonyms
899941-95-8899941958
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53)C
InChI=1SC25H25N3O4Sc11591017(1216(15)2)2621(29)143325272219734820(19)3223(22)24(30)28(25)131865113118h347101218H56111314H212H3(H2629)
MFCD07650716
N(34DIMETHYLPHENYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(34dimethylphenyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(34dimethylphenyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009750502
ZINC000009750516
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