Vitas-M small molecule compound
2-(4-chlorophenoxy)-1-{3-phenyl-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}ethanone
Catalog ID
STK211627
SMILES Clc1ccc(cc1)OCC(=O)n1nc(nc1NCc1cccs1)c1ccccc1
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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 C21H17ClN4O2S MW 424.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O2S/c22-16-8-10-17(11-9-16)28-14-19(27)26-21(23-13-18-7-4-12-29-18)24-20(25-26)15-5-2-1-3-6-15/h1-12H,13-14H2,(H,23,24,25)InChIKey
QNJRWTHXVWKFSA-UHFFFAOYSA-NSynonyms
2(4CHLOROPHENOXY)1(3PHENYL5((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)ETHANONE
2(4CHLOROPHENOXY)1(3PHENYL5(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)ETHANONE
C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CS3)C(=O)COC4=CC=C(C=C4)Cl
InChI=1SC21H17ClN4O2Sc221681017(11916)281419(27)2621(23131874122918)2420(2526)155213615h112H1314H2(H232425)
MFCD08671590
ZINC000010076636
ZINC10076636
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