Vitas-M small molecule compound

2-[5-(3,5-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(4-methylbenzyl)acetamide

Catalog ID
STL193028
SMILES O=C(CN1N=NC2C1C(=O)N(C2=O)c1cc(C)cc(c1)C)NCc1ccc(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 C22H23N5O3 MW 405.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3/c1-13-4-6-16(7-5-13)11-23-18(28)12-26-20-19(24-25-26)21(29)27(22(20)30)17-9-14(2)8-15(3)10-17/h4-10,19-20H,11-12H2,1-3H3,(H,23,28)
InChIKey
ZAEVOYHFMFTLEO-UHFFFAOYSA-N
Synonyms
1008237-75-9
1008237759
2(5(35dimethylphenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)N((4methylphenyl)methyl)acetamide
2(5(35dimethylphenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)N(4methylbenzyl)acetamide
CC1=CC=C(C=C1)CNC(=O)CN2C3C(C(=O)N(C3=O)C4=CC(=CC(=C4)C)C)N=N2
InChI=1SC22H23N5O3c1134616(7513)112318(28)12262019(242526)21(29)27(22(20)30)17914(2)815(3)1017h4101920H1112H213H3(H2328)
MFCD07650247
ZINC000004852081
ZINC000101083570

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Available files

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