Vitas-M small molecule compound

(2Z)-2-({3-[4-(butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one

Catalog ID
STK881151
SMILES CCCCSc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)c1c(n2)cccc1)c1ccccc1

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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 C29H24N4OS2 MW 508.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4OS2/c1-2-3-17-35-23-15-13-20(14-16-23)27-21(19-32(31-27)22-9-5-4-6-10-22)18-26-28(34)33-25-12-8-7-11-24(25)30-29(33)36-26/h4-16,18-19H,2-3,17H2,1H3/b26-18-
InChIKey
VUGMCBWUPYUJPS-ITYLOYPMSA-N
Synonyms
1008880-03-2
(2Z)2((3(4(butylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((3(4BUTYLSULFANYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(Z)2((3(4(butylthio)phenyl)1phenyl1Hpyrazol4yl)methylene)benzo(45)imidazo(21b)thiazol3(2H)one
1008880032
CCCCSC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6
CCCCSc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
InChI=1SC29H24N4OS2c123173523151320(141623)2721(1932(3127)2295461022)182628(34)332512871124(25)3029(33)3626h4161819H2317H21H3b2618
MFCD03693421
ZINC000009463589
ZINC09463589
ZINC9463589

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Available files

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