Vitas-M small molecule compound

4-chloro-N-(4-{3-[(4,6-dimethylpyrimidin-2-yl)amino]-1H-1,2,4-triazol-5-yl}phenyl)benzamide

Catalog ID
STK261551
SMILES Clc1ccc(cc1)C(=O)Nc1ccc(cc1)c1[nH]nc(n1)Nc1nc(C)cc(n1)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 C21H18ClN7O MW 419.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN7O/c1-12-11-13(2)24-20(23-12)27-21-26-18(28-29-21)14-5-9-17(10-6-14)25-19(30)15-3-7-16(22)8-4-15/h3-11H,1-2H3,(H,25,30)(H2,23,24,26,27,28,29)
InChIKey
HYYXXYJJUMEHQC-UHFFFAOYSA-N
Synonyms
886182-19-0
4chloroN(4(3((46dimethylpyrimidin2yl)amino)1H124triazol5yl)phenyl)benzamide
886182190
CC1=CC(=NC(=N1)NC2=NNC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl)C
Clc1ccc(cc1)C(=O)Nc1ccc(cc1)c1(nH)nc(n1)Nc1nc(C)cc(n1)C
InChI=1SC21H18ClN7Oc1121113(2)2420(2312)27212618(282921)145917(10614)2519(30)153716(22)8415h311H12H3(H2530)(H2232426272829)
MFCD07181638
N(4(3((46DIMETHYLPYRIMIDIN2YL)AMINO)(1H124TRIAZOL5YL))PHENYL)(4CHLOROPHENYL)CARBOXAMIDE
ZINC000009341686
ZINC09341686
ZINC9341686

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Available files

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