Vitas-M small molecule compound
(2E)-2-{[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK822878
SMILES CCOc1ccc(cc1C)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 C28H22N4O2S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O2S/c1-3-34-24-14-13-19(15-18(24)2)26-20(17-31(30-26)21-9-5-4-6-10-21)16-25-27(33)32-23-12-8-7-11-22(23)29-28(32)35-25/h4-17H,3H2,1-2H3/b25-16+InChIKey
JNURMYJJNVYPHU-PCLIKHOPSA-NSynonyms
(2E)2((3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2E)2((3(4ethoxy3methylphenyl)1phenylpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol1one
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6)C
CCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
InChI=1SC28H22N4O2Sc133424141319(1518(24)2)2620(1731(3026)2195461021)162527(33)322312871122(23)2928(32)3525h417H3H212H3b2516+
MFCD03463465
ZINC000027017760
ZINC27017760
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