Vitas-M small molecule compound

[5-amino-3-(4-methylphenyl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone

Catalog ID
STK137819
SMILES COc1cc(ccc1OC)C(=O)n1nc(nc1N)c1ccc(cc1)C

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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 C18H18N4O3 MW 338.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3/c1-11-4-6-12(7-5-11)16-20-18(19)22(21-16)17(23)13-8-9-14(24-2)15(10-13)25-3/h4-10H,1-3H3,(H2,19,20,21)
InChIKey
FFDMJRPXWNAPBP-UHFFFAOYSA-N
Synonyms

(5AMINO3(4METHYLPHENYL)124TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
(5AMINO3(4METHYLPHENYL)1H124TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
(5AMINO3(PTOLYL)124TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
(5AMINO3PTOLYL(124)TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
(5AZANYL3(4METHYLPHENYL)124TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
CC1=CC=C(C=C1)C2=NN(C(=N2)N)C(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC18H18N4O3c1114612(7511)162018(19)22(2116)17(23)138914(242)15(1013)253h410H13H3(H2192021)
MFCD05239522
ZINC000000800885
ZINC00800885
ZINC800885

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Available files

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