Vitas-M small molecule compound

(2E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-(prop-2-yn-1-yloxy)phenyl]prop-2-enenitrile

Catalog ID
STK294092
SMILES C#CCOc1cccc(c1)/C=C(/Sc1nc2c(s1)cccc2)\C#N

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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 C19H12N2OS2 MW 348.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N2OS2/c1-2-10-22-15-7-5-6-14(11-15)12-16(13-20)23-19-21-17-8-3-4-9-18(17)24-19/h1,3-9,11-12H,10H2/b16-12+
InChIKey
IXYQFMFZYBTVDP-FOWTUZBSSA-N
Synonyms

(2E)2(13benzothiazol2ylsulfanyl)3(3(prop2yn1yloxy)phenyl)prop2enenitrile
(E)2(13BENZOTHIAZOL2YLSULFANYL)3(3PROP2YNOXYPHENYL)PROP2ENENITRILE
C#CCOC1=CC=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2
C#CCOc1cccc(c1)C=C(Sc1nc2c(s1)cccc2)C#N
InChI=1SC19H12N2OS2c1210221575614(1115)1216(1320)23192117834918(17)2419h1391112H10H2b1612+
MFCD06624128
ZINC000003017730
ZINC03017730
ZINC3017730

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Available files

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