Vitas-M small molecule compound
5-[(4-chlorophenoxy)methyl]-4-cyclopropyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK891268
SMILES Clc1ccc(cc1)OCc1nnc(n1C1CC1)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 C12H12ClN3OS MW 281.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12ClN3OS/c13-8-1-5-10(6-2-8)17-7-11-14-15-12(18)16(11)9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,15,18)InChIKey
QSWIIYLTGQBSLY-UHFFFAOYSA-NSynonyms
3((4chlorophenoxy)methyl)4cyclopropyl1H124triazole5thione
5((4chlorophenoxy)methyl)4cyclopropyl4H124triazole3thiol
C1CC1N2C(=NNC2=S)COC3=CC=C(C=C3)Cl
InChI=1SC12H12ClN3OSc1381510(628)17711141512(18)16(11)9349h12569H347H2(H1518)
MFCD09983427
ZINC000011692615
ZINC11692615
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