Vitas-M small molecule compound

3-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pentane-2,4-dione

Catalog ID
STK663578
SMILES Clc1ccc(cc1)c1nnc(n1c1ccccc1)SC(C(=O)C)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 C19H16ClN3O2S MW 385.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O2S/c1-12(24)17(13(2)25)26-19-22-21-18(14-8-10-15(20)11-9-14)23(19)16-6-4-3-5-7-16/h3-11,17H,1-2H3
InChIKey
UWTZXKBZIGUIRB-UHFFFAOYSA-N
Synonyms

3((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)PENTANE24DIONE
3((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)pentane24dione
CC(=O)C(C(=O)C)SC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI=1SC19H16ClN3O2Sc112(24)17(13(2)25)2619222118(1481015(20)11914)23(19)166435716h31117H12H3
MFCD02018997
ZINC000000716941
ZINC00716941
ZINC716941

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Available files

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