Vitas-M small molecule compound

(5E)-5-benzylidene-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK814753
SMILES Clc1ccc(cc1)c1nn2c(n1)s/c(=C/c1ccccc1)/c2=O

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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 C17H10ClN3OS MW 339.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10ClN3OS/c18-13-8-6-12(7-9-13)15-19-17-21(20-15)16(22)14(23-17)10-11-4-2-1-3-5-11/h1-10H/b14-10+
InChIKey
CISPSPLXHDRSDS-GXDHUFHOSA-N
Synonyms

(5E)5benzylidene2(4chlorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)5BENZYLIDENE2(4CHLOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
C1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)Cl)S2
Clc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccccc1)c2=O
InChI=1SC17H10ClN3OSc18138612(7913)15191721(2015)16(22)14(2317)10114213511h110Hb1410+
MFCD00203405
ZINC000000124310
ZINC00124310
ZINC124310

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.