Vitas-M small molecule compound
4-{[4-(benzyloxy)-3-chloro-5-methoxybenzyl]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STL308485
SMILES COc1cc(CNn2cnnc2S)cc(c1OCc1ccccc1)Cl
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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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-23-15-8-13(9-20-22-11-19-21-17(22)25)7-14(18)16(15)24-10-12-5-3-2-4-6-12/h2-8,11,20H,9-10H2,1H3,(H,21,25)InChIKey
HTGLWLQNFCHDJO-UHFFFAOYSA-NSynonyms
4(((3CHLORO5METHOXY4(PHENYLMETHOXY)PHENYL)METHYL)AMINO)124TRIAZOLE3THIOL
4((3CHLORO5METHOXY4PHENYLMETHOXYPHENYL)METHYLAMINO)1H124TRIAZOLE5THIONE
4((4(BENZYLOXY)3CHLORO5METHOXYBENZYL)AMINO)4H124TRIAZOL3YLHYDROSULFIDE
4((4(benzyloxy)3chloro5methoxybenzyl)amino)4H124triazole3thiol
4(4BENZYLOXY3CHLORO5METHOXYBENZYLAMINO)4H(124)TRIAZOLE3THIOL
COC1=C(C(=CC(=C1)CNN2C=NNC2=S)Cl)OCC3=CC=CC=C3
InChI=1SC17H17ClN4O2Sc12315813(9202211192117(22)25)714(18)16(15)2410125324612h281120H910H21H3(H2125)
MFCD03698252
ZINC000005432781
ZINC05432781
ZINC5432781
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