Vitas-M small molecule compound

{5-[(4-chlorophenyl)amino]-1H-1,2,3-triazol-4-yl}[4-(3-chlorophenyl)piperazin-1-yl]methanone

Catalog ID
STL098829
SMILES Clc1ccc(cc1)Nc1[nH]nnc1C(=O)N1CCN(CC1)c1cccc(c1)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 C19H18Cl2N6O MW 417.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N6O/c20-13-4-6-15(7-5-13)22-18-17(23-25-24-18)19(28)27-10-8-26(9-11-27)16-3-1-2-14(21)12-16/h1-7,12H,8-11H2,(H2,22,23,24,25)
InChIKey
HGKSJBGVPHKJCA-UHFFFAOYSA-N
Synonyms
1291834-01-9
(5((4chlorophenyl)amino)1H123triazol4yl)(4(3chlorophenyl)piperazin1yl)methanone
(5(4chloroanilino)2Htriazol4yl)(4(3chlorophenyl)piperazin1yl)methanone
1291834019
C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=NNN=C3NC4=CC=C(C=C4)Cl
Clc1ccc(cc1)Nc1(nH)nnc1C(=O)N1CCN(CC1)c1cccc(c1)Cl
InChI=1SC19H18Cl2N6Oc20134615(7513)221817(23252418)19(28)2710826(91127)1631214(21)1216h1712H811H2(H222232425)
MFCD18790072
ZINC000067284343
ZINC67284343

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Available files

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