Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)[1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl]methanone

Catalog ID
STL083322
SMILES O=C(c1nnn(c1)c1ccccc1Cl)N1CCN(CC1)Cc1ccccc1

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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 C20H20ClN5O MW 381.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O/c21-17-8-4-5-9-19(17)26-15-18(22-23-26)20(27)25-12-10-24(11-13-25)14-16-6-2-1-3-7-16/h1-9,15H,10-14H2
InChIKey
UEGXOEVHSKCYQD-UHFFFAOYSA-N
Synonyms

(4benzylpiperazin1yl)(1(2chlorophenyl)1H123triazol4yl)methanone
(4benzylpiperazin1yl)(1(2chlorophenyl)triazol4yl)methanone
1BENZYL4((1(2CHLOROPHENYL)1H123TRIAZOL4YL)CARBONYL)PIPERAZINE
C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CN(N=N3)C4=CC=CC=C4Cl
InChI=1SC20H20ClN5Oc2117845919(17)261518(222326)20(27)25121024(111325)14166213716h1915H1014H2
MFCD18202164
ZINC000021358718
ZINC21358718

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Available files

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