Vitas-M small molecule compound
[3-(benzylamino)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl](4-chlorophenyl)methanone
Catalog ID
STK852810
SMILES Clc1ccc(cc1)C(=O)n1c(NCc2ccccc2)n[nH]c1=S
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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 C16H13ClN4OS MW 344.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4OS/c17-13-8-6-12(7-9-13)14(22)21-15(19-20-16(21)23)18-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,18,19)(H,20,23)InChIKey
OHQOPWVMOVQLSE-UHFFFAOYSA-NSynonyms
713112-97-1713112971
Clc1ccc(cc1)C(=O)n1c(NCc2ccccc2)n(nH)c1=S
MFCD07197444
ZINC000005999237
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