Vitas-M small molecule compound
2-({5-[(2,4-dichlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methylpiperidin-1-yl)ethanone
Catalog ID
STL376827
SMILES CC1CCN(CC1)C(=O)CSc1nnc(n1C)COc1ccc(cc1Cl)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 C18H22Cl2N4O2S MW 429.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22Cl2N4O2S/c1-12-5-7-24(8-6-12)17(25)11-27-18-22-21-16(23(18)2)10-26-15-4-3-13(19)9-14(15)20/h3-4,9,12H,5-8,10-11H2,1-2H3InChIKey
ILBMLWQJZCBOQX-UHFFFAOYSA-NSynonyms
2((5((24DICHLOROPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)1(4METHYLPIPERIDIN1YL)ETHANONE
2((5((24dichlorophenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)1(4methylpiperidin1yl)ethanone
CC1CCN(CC1)C(=O)CSC2=NN=C(N2C)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC18H22Cl2N4O2Sc1125724(8612)17(25)112718222116(23(18)2)1026154313(19)914(15)20h34912H581011H212H3
MFCD07790030
ZINC000009236120
ZINC09236120
ZINC9236120
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