Vitas-M small molecule compound
5-benzyl-2-(4-chlorophenyl)-5-methyl-1,2,4-triazolidine-3-thione
Catalog ID
STL482364
SMILES Clc1ccc(cc1)N1NC(NC1=S)(C)Cc1ccccc1
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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 C16H16ClN3S MW 317.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3S/c1-16(11-12-5-3-2-4-6-12)18-15(21)20(19-16)14-9-7-13(17)8-10-14/h2-10,19H,11H2,1H3,(H,18,21)InChIKey
OWKHDSDPDIAQGP-UHFFFAOYSA-NSynonyms
5benzyl2(4chlorophenyl)5methyl124triazolidine3thione
CC1(NC(=S)N(N1)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3
InChI=1SC16H16ClN3Sc116(11125324612)1815(21)20(1916)149713(17)81014h21019H11H21H3(H1821)
MFCD30713291
ZINC000334160923
ZINC000334160924
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