Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-4-[1-(2-chloro-4-fluorobenzyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide
Catalog ID
STL145722
SMILES O=C(NCc1ccc2c(c1)OCO2)CCCn1c(=O)c2ccccc2n(c1=O)Cc1ccc(cc1Cl)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 C27H23ClFN3O5 MW 523.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClFN3O5/c28-21-13-19(29)9-8-18(21)15-32-22-5-2-1-4-20(22)26(34)31(27(32)35)11-3-6-25(33)30-14-17-7-10-23-24(12-17)37-16-36-23/h1-2,4-5,7-10,12-13H,3,6,11,14-16H2,(H,30,33)InChIKey
OTUIPBQNRDOWNS-UHFFFAOYSA-NSynonyms
899910-74-8899910748
C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCN3C(=O)C4=CC=CC=C4N(C3=O)CC5=C(C=C(C=C5)F)Cl
InChI=1SC27H23ClFN3O5c28211319(29)9818(21)153222521420(22)26(34)31(27(32)35)113625(33)3014177102324(1217)37163623h12457101213H36111416H2(H3033)
MFCD14737583
N(13benzodioxol5ylmethyl)4(1((2chloro4fluorophenyl)methyl)24dioxoquinazolin3yl)butanamide
N(13benzodioxol5ylmethyl)4(1(2chloro4fluorobenzyl)24dioxo14dihydroquinazolin3(2H)yl)butanamide
ZINC000100036821
ZINC100036821
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