Vitas-M small molecule compound
2-{[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(4-fluorobenzyl)acetamide
Catalog ID
STL108282
SMILES O=C(CSc1nc2ccccc2c(=O)n1Cc1ccc2c(c1)OCO2)NCc1ccc(cc1)F
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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 C25H20FN3O4S MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O4S/c26-18-8-5-16(6-9-18)12-27-23(30)14-34-25-28-20-4-2-1-3-19(20)24(31)29(25)13-17-7-10-21-22(11-17)33-15-32-21/h1-11H,12-15H2,(H,27,30)InChIKey
NOHJHSMNKKMUHU-UHFFFAOYSA-NSynonyms
2((3(13benzodioxol5ylmethyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(4fluorobenzyl)acetamide
2(3(13benzodioxol5ylmethyl)4oxoquinazolin2yl)sulfanylN((4fluorophenyl)methyl)acetamide
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCC5=CC=C(C=C5)F
InChI=1SC25H20FN3O4Sc26188516(6918)122723(30)1434252820421319(20)24(31)29(25)13177102122(1117)33153221h111H1215H2(H2730)
MFCD20742783
ZINC000067291132
ZINC67291132
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