Vitas-M small molecule compound

trans-4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-N-(4H-1,2,4-triazol-4-yl)cyclohexanecarboxamide

Catalog ID
STL226469
SMILES O=C([C@@H]1CC[C@H](CC1)Cn1nnc2c(c1=O)cccc2)Nn1cnnc1

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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 C17H19N7O2 MW 353.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7O2/c25-16(21-23-10-18-19-11-23)13-7-5-12(6-8-13)9-24-17(26)14-3-1-2-4-15(14)20-22-24/h1-4,10-13H,5-9H2,(H,21,25)/t12-,13-
InChIKey
GTWPVUKKNMMDOY-JOCQHMNTSA-N
Synonyms

4((4oxobenzo(d)(123)triazin3(4H)yl)methyl)N(4H124triazol4yl)cyclohexanecarboxamide
MFCD12925891
O=C((C@@H)1CC(C@H)(CC1)Cn1nnc2c(c1=O)cccc2)Nn1cnnc1
O=C(C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)Nn1cnnc1
trans4((4oxo123benzotriazin3(4H)yl)methyl)N(4H124triazol4yl)cyclohexanecarboxamide
ZINC000238899599

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Available files

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