Vitas-M small molecule compound

(4Z)-1-(3-chlorophenyl)-4-[(2,6-dimethylphenyl)imino]-1,3-diazaspiro[4.4]nonane-2-thione

Catalog ID
STK837643
SMILES Clc1cccc(c1)N1C(=S)N/C(=N\c2c(C)cccc2C)/C21CCCC2

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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 C21H22ClN3S MW 383.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3S/c1-14-7-5-8-15(2)18(14)23-19-21(11-3-4-12-21)25(20(26)24-19)17-10-6-9-16(22)13-17/h5-10,13H,3-4,11-12H2,1-2H3,(H,23,24,26)
InChIKey
QTSRADJSEDGFML-UHFFFAOYSA-N
Synonyms
300404-68-6
(4Z)1(3chlorophenyl)4((26dimethylphenyl)imino)13diazaspiro(44)nonane2thione
(Z)1(3chlorophenyl)4((26dimethylphenyl)imino)13diazaspiro(44)nonane2thione
1(3chlorophenyl)4(26dimethylanilino)13diazaspiro(44)non3ene2thione
300404686
9(3CHLOROPHENYL)6(26DIMETHYLANILINO)79DIAZASPIRO(44)NON6ENE8THIONE
CC1=C(C(=CC=C1)C)NC2=NC(=S)N(C23CCCC3)C4=CC(=CC=C4)Cl
Clc1cccc(c1)N1C(=S)NC(=Nc2c(C)cccc2C)C21CCCC2
InChI=1SC21H22ClN3Sc11475815(2)18(14)231921(11341221)25(20(26)2419)17106916(22)1317h51013H341112H212H3(H232426)
MFCD00367946
ZINC000005427330
ZINC05427330
ZINC5427330

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Available files

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