Vitas-M small molecule compound

2-{[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK699404
SMILES NC(=O)CSc1nnc(n1C)c1cccc(c1)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 C12H14N4OS MW 262.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4OS/c1-8-4-3-5-9(6-8)11-14-15-12(16(11)2)18-7-10(13)17/h3-6H,7H2,1-2H3,(H2,13,17)
InChIKey
GNJIXHSXOXEOSQ-UHFFFAOYSA-N
Synonyms
485332-62-5
2((4METHYL5(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
2((4methyl5(3methylphenyl)4H124triazol3yl)sulfanyl)acetamide
2((4methyl5(mtolyl)4H124triazol3yl)thio)acetamide
485332625
CC1=CC=CC(=C1)C2=NN=C(N2C)SCC(=O)N
InChI=1SC12H14N4OSc184359(68)11141512(16(11)2)18710(13)17h36H7H212H3(H21317)
MFCD02589919
ZINC000000421943
ZINC00421943
ZINC421943

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Available files

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