Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-7-{[(2E)-3-phenylprop-2-en-1-yl]oxy}-2H-chromen-2-one

Catalog ID
STK837473
SMILES O=c1oc2cc(OC/C=C/c3ccccc3)ccc2cc1c1nc2c(s1)cccc2

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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 C25H17NO3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17NO3S/c27-25-20(24-26-21-10-4-5-11-23(21)30-24)15-18-12-13-19(16-22(18)29-25)28-14-6-9-17-7-2-1-3-8-17/h1-13,15-16H,14H2/b9-6+
InChIKey
DPNIBHYPAHJSHB-RMKNXTFCSA-N
Synonyms

3(13benzothiazol2yl)7(((2E)3phenylprop2en1yl)oxy)2Hchromen2one
3(13BENZOTHIAZOL2YL)7((E)3PHENYLPROP2ENOXY)CHROMEN2ONE
3(benzo(d)thiazol2yl)7(cinnamyloxy)2Hchromen2one
7((2E)3PHENYLPROP2ENYLOXY)3BENZOTHIAZOL2YLCHROMEN2ONE
C1=CC=C(C=C1)C=CCOC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5S4
InChI=1SC25H17NO3Sc272520(24262110451123(21)3024)1518121319(1622(18)2925)281469177213817h1131516H14H2b96+
MFCD01958316
O=c1oc2cc(OCC=Cc3ccccc3)ccc2cc1c1nc2c(s1)cccc2
ZINC000002287487
ZINC02287487
ZINC2287487

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Available files

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