Vitas-M small molecule compound
1-{4-[4-({5-[(3-chlorophenyl)amino]-1H-1,2,3-triazol-4-yl}carbonyl)piperazin-1-yl]phenyl}ethanone
Catalog ID
STL098948
SMILES Clc1cccc(c1)Nc1[nH]nnc1C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)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 C21H21ClN6O2 MW 424.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN6O2/c1-14(29)15-5-7-18(8-6-15)27-9-11-28(12-10-27)21(30)19-20(25-26-24-19)23-17-4-2-3-16(22)13-17/h2-8,13H,9-12H2,1H3,(H2,23,24,25,26)InChIKey
ULIFLGRGQUSLAM-UHFFFAOYSA-NSynonyms
1(4(4((5((3chlorophenyl)amino)1H123triazol4yl)carbonyl)piperazin1yl)phenyl)ethanone
1(4(4(5(3chloroanilino)2Htriazole4carbonyl)piperazin1yl)phenyl)ethanone
CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NNN=C3NC4=CC(=CC=C4)Cl
Clc1cccc(c1)Nc1(nH)nnc1C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)C
InChI=1SC21H21ClN6O2c114(29)155718(8615)2791128(121027)21(30)1920(25262419)231742316(22)1317h2813H912H21H3(H223242526)
MFCD18790191
ZINC000067284706
ZINC67284706
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