Vitas-M small molecule compound

N-benzyl-2-({5-[(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamide

Catalog ID
STL012001
SMILES O=C(CSc1nnc(o1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)NCc1ccccc1

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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 C24H18N4O4S MW 458.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O4S/c29-19(25-12-15-6-2-1-3-7-15)14-33-24-27-26-20(32-24)13-28-22(30)17-10-4-8-16-9-5-11-18(21(16)17)23(28)31/h1-11H,12-14H2,(H,25,29)
InChIKey
BZNBKJOYNAPGRO-UHFFFAOYSA-N
Synonyms

C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(O2)CN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O
InChI=1SC24H18N4O4Sc2919(2512156213715)143324272620(3224)132822(30)17104816951118(21(16)17)23(28)31h111H1214H2(H2529)
MFCD18185467
Nbenzyl2((5((13dioxo1Hbenzo(de)isoquinolin2(3H)yl)methyl)134oxadiazol2yl)sulfanyl)acetamide
Nbenzyl2((5((13dioxobenzo(de)isoquinolin2yl)methyl)134oxadiazol2yl)sulfanyl)acetamide
ZINC000051353962
ZINC51353962

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Available files

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