Vitas-M small molecule compound
2-[(3-cyclopentyl-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STL085250
SMILES O=C(Nc1ccc(c(c1)C)C)CSc1nc2c3ccccc3oc2c(=O)n1C1CCCC1
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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 C25H25N3O3S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S/c1-15-11-12-17(13-16(15)2)26-21(29)14-32-25-27-22-19-9-5-6-10-20(19)31-23(22)24(30)28(25)18-7-3-4-8-18/h5-6,9-13,18H,3-4,7-8,14H2,1-2H3,(H,26,29)InChIKey
CQCXKNZICJPFCH-UHFFFAOYSA-NSynonyms
899962-38-02((3cyclopentyl4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(34dimethylphenyl)acetamide
2((3cyclopentyl4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(34dimethylphenyl)acetamide
2((3CYCLOPENTYL4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)N(34DIMETHYLPHENYL)ACETAMIDE
899962380
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4CCCC4)OC5=CC=CC=C53)C
InChI=1SC25H25N3O3Sc115111217(1316(15)2)2621(29)1432252722199561020(19)3123(22)24(30)28(25)18734818h5691318H347814H212H3(H2629)
MFCD07650912
ZINC000009752448
ZINC09752448
ZINC9752448
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