Vitas-M small molecule compound
(8Z)-2-amino-8-(4-chlorobenzylidene)-4-(4-chlorophenyl)-7,8-dihydro-4H,5H-thiopyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK782598
SMILES N#CC1=C(N)OC2=C(C1c1ccc(cc1)Cl)CSC/C/2=C\c1ccc(cc1)Cl
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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 C22H16Cl2N2OS MW 427.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N2OS/c23-16-5-1-13(2-6-16)9-15-11-28-12-19-20(14-3-7-17(24)8-4-14)18(10-25)22(26)27-21(15)19/h1-9,20H,11-12,26H2/b15-9+InChIKey
LRJMUNVLMCQCCQ-OQLLNIDSSA-NSynonyms
(8Z)2AMINO4(4CHLOROPHENYL)8((4CHLOROPHENYL)METHYLIDENE)45DIHYDROTHIOPYRANO(43B)PYRAN3CARBONITRILE
(8Z)2amino8(4chlorobenzylidene)4(4chlorophenyl)78dihydro4H5Hthiopyrano(43b)pyran3carbonitrile
C1C(=CC2=CC=C(C=C2)Cl)C3=C(CS1)C(C(=C(O3)N)C#N)C4=CC=C(C=C4)Cl
InChI=1SC22H16Cl2N2OSc23165113(2616)9151128121920(143717(24)8414)18(1025)22(26)2721(15)19h1920H111226H2b159+
MFCD06017852
N#CC1=C(N)OC2=C(C1c1ccc(cc1)Cl)CSCC2=Cc1ccc(cc1)Cl
ZINC000012428926
ZINC000012428927
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