Vitas-M small molecule compound
5-{4-[(4-chloro-3-methylphenoxy)methyl]phenyl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307329
SMILES Clc1ccc(cc1C)OCc1ccc(cc1)c1nnc(n1CCCN1CCOCC1)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 C23H27ClN4O2S MW 459.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN4O2S/c1-17-15-20(7-8-21(17)24)30-16-18-3-5-19(6-4-18)22-25-26-23(31)28(22)10-2-9-27-11-13-29-14-12-27/h3-8,15H,2,9-14,16H2,1H3,(H,26,31)InChIKey
PJMOZZBATYKDRD-UHFFFAOYSA-NSynonyms
828291-47-03(4((4CHLORO3METHYLPHENOXY)METHYL)PHENYL)4(3MORPHOLIN4YLPROPYL)1H124TRIAZOLE5THIONE
5(4((4chloro3methylphenoxy)methyl)phenyl)4(3(morpholin4yl)propyl)4H124triazole3thiol
828291470
CC1=C(C=CC(=C1)OCC2=CC=C(C=C2)C3=NNC(=S)N3CCCN4CCOCC4)Cl
InChI=1SC23H27ClN4O2Sc1171520(7821(17)24)3016183519(6418)22252623(31)28(22)102927111329141227h3815H291416H21H3(H2631)
MFCD04053665
ZINC000020028649
ZINC20028649
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