Vitas-M small molecule compound

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

Catalog ID
STK811987
SMILES C=CCOc1ccc(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 C28H20N4O2S MW 476.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N4O2S/c1-2-16-34-22-14-12-19(13-15-22)26-20(18-31(30-26)21-8-4-3-5-9-21)17-25-27(33)32-24-11-7-6-10-23(24)29-28(32)35-25/h2-15,17-18H,1,16H2/b25-17-
InChIKey
SUAQRVNHWYDGSU-UQQQWYQISA-N
Synonyms

(2Z)2((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(Z)2((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)benzo(45)imidazo(21b)thiazol3(2H)one
C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6
C=CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
InChI=1SC28H20N4O2Sc12163422141219(131522)2620(1831(3026)218435921)172527(33)322411761023(24)2928(32)3525h2151718H116H2b2517
MFCD02985426
ZINC000009044072
ZINC09044072
ZINC9044072

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Available files

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