Vitas-M small molecule compound

(2Z)-13-acetyl-2-(4-fluorobenzylidene)-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one

Catalog ID
STK777934
SMILES CC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)/c(=C/c2ccc(cc2)F)/s1

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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 C22H17FN2O3S MW 408.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN2O3S/c1-12(26)18-19-15-5-3-4-6-16(15)28-22(18,2)24-21-25(19)20(27)17(29-21)11-13-7-9-14(23)10-8-13/h3-11,18-19H,1-2H3/b17-11-
InChIKey
LOSWCVOYUDMQDU-BOPFTXTBSA-N
Synonyms
1008414-19-4
(2Z)13acetyl2(4fluorobenzylidene)5methyl5H11H511methano(13)thiazolo(23d)(135)benzoxadiazocin1(2H)one
1008414194
CC(=O)C1C2C3=CC=CC=C3OC1(N=C4N2C(=O)C(=CC5=CC=C(C=C5)F)S4)C
CC(=O)C1C2c3ccccc3OC1(C)N=c1n2c(=O)c(=Cc2ccc(cc2)F)s1
InChI=1SC22H17FN2O3Sc112(26)181915534616(15)2822(182)242125(19)20(27)17(2921)11137914(23)10813h3111819H12H3b1711
MFCD04227937
ZINC000103014747
ZINC000103014748

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Available files

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