Vitas-M small molecule compound
N-(2,3-dimethylphenyl)-2-{[3-(4-fluorophenyl)-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL085684
SMILES O=C(Nc1cccc(c1C)C)CSc1nc2c(c(=O)n1c1ccc(cc1)F)oc1c2cccc1
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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 C26H20FN3O3S MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20FN3O3S/c1-15-6-5-8-20(16(15)2)28-22(31)14-34-26-29-23-19-7-3-4-9-21(19)33-24(23)25(32)30(26)18-12-10-17(27)11-13-18/h3-13H,14H2,1-2H3,(H,28,31)InChIKey
ZXKRZFBFGLIPED-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)OC5=CC=CC=C53)C
InChI=1SC26H20FN3O3Sc11565820(16(15)2)2822(31)143426292319734921(19)3324(23)25(32)30(26)18121017(27)111318h313H14H212H3(H2831)
MFCD14792378
N(23dimethylphenyl)2((3(4fluorophenyl)4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(23dimethylphenyl)2((3(4fluorophenyl)4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009834228
ZINC9834228
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