Vitas-M small molecule compound

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

Catalog ID
STL098781
SMILES CCc1ccc(cc1)Nc1[nH]nnc1C(=O)N1CCN(CC1)c1cccc(c1C)C

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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 C23H28N6O MW 404.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O/c1-4-18-8-10-19(11-9-18)24-22-21(25-27-26-22)23(30)29-14-12-28(13-15-29)20-7-5-6-16(2)17(20)3/h5-11H,4,12-15H2,1-3H3,(H2,24,25,26,27)
InChIKey
KKKGUZZYYUHHND-UHFFFAOYSA-N
Synonyms
1291860-65-5
(4(23dimethylphenyl)piperazin1yl)(5((4ethylphenyl)amino)1H123triazol4yl)methanone
(4(23dimethylphenyl)piperazin1yl)(5(4ethylanilino)2Htriazol4yl)methanone
1291860655
CCC1=CC=C(C=C1)NC2=NNN=C2C(=O)N3CCN(CC3)C4=CC=CC(=C4C)C
CCc1ccc(cc1)Nc1(nH)nnc1C(=O)N1CCN(CC1)c1cccc(c1C)C
InChI=1SC23H28N6Oc141881019(11918)242221(25272622)23(30)29141228(131529)2075616(2)17(20)3h511H41215H213H3(H224252627)
MFCD18790024
ZINC000067284194
ZINC67284194

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Available files

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