Vitas-M small molecule compound
3-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STK468715
SMILES Cc1cccc(c1)CSc1nnc(n1C)COc1ccc(c(c1)C)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 C19H20ClN3OS MW 373.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3OS/c1-13-5-4-6-15(9-13)12-25-19-22-21-18(23(19)3)11-24-16-7-8-17(20)14(2)10-16/h4-10H,11-12H2,1-3H3InChIKey
PBVRNPVZNOYHQH-UHFFFAOYSA-NSynonyms
1CHLORO2METHYL4((4METHYL5((3METHYLPHENYL)METHYLTHIO)(124TRIAZOL3YL))METHOXY)BENZENE
3((4chloro3methylphenoxy)methyl)4methyl5((3methylbenzyl)sulfanyl)4H124triazole
3((4chloro3methylphenoxy)methyl)4methyl5((3methylphenyl)methylsulfanyl)124triazole
CC1=CC(=CC=C1)CSC2=NN=C(N2C)COC3=CC(=C(C=C3)Cl)C
InChI=1SC19H20ClN3OSc11354615(913)122519222118(23(19)3)1124167817(20)14(2)1016h410H1112H213H3
MFCD06189284
ZINC000017076537
ZINC17076537
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