Vitas-M small molecule compound

1-chloro-3-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol

Catalog ID
STL324221
SMILES ClCC(CSc1nnc(n1C)c1ccccc1)O

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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 C12H14ClN3OS MW 283.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN3OS/c1-16-11(9-5-3-2-4-6-9)14-15-12(16)18-8-10(17)7-13/h2-6,10,17H,7-8H2,1H3
InChIKey
ZYUHFPMOGSEIIC-UHFFFAOYSA-N
Synonyms
125707-63-3
125707633
1CHLORO3((4METHYL5PHENYL124TRIAZOL3YL)SULFANYL)PROPAN2OL
1chloro3((4methyl5phenyl4H124triazol3yl)sulfanyl)propan2ol
1chloro3((4methyl5phenyl4H124triazol3yl)thio)propan2ol
CN1C(=NN=C1SCC(CCl)O)C2=CC=CC=C2
InChI=1SC12H14ClN3OSc11611(9532469)141512(16)18810(17)713h261017H78H21H3
MFCD01085017
ZINC000000496206
ZINC000000496207

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.