Vitas-M small molecule compound

1-(4-bromophenyl)-5-methyl-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK864959
SMILES CC(NC(=O)c1nnn(c1C)c1ccc(cc1)Br)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 C13H15BrN4O MW 323.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15BrN4O/c1-8(2)15-13(19)12-9(3)18(17-16-12)11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,19)
InChIKey
BHPOXSNQBIGXNC-UHFFFAOYSA-N
Synonyms
950237-35-1
(1(4BROMOPHENYL)5METHYL(123TRIAZOL4YL))N(METHYLETHYL)CARBOXAMIDE
1(4bromophenyl)5methylN(propan2yl)1H123triazole4carboxamide
1(4bromophenyl)5methylNpropan2yltriazole4carboxamide
1(4bromophenyl)Nisopropyl5methyl1H123triazole4carboxamide
950237351
CC1=C(N=NN1C2=CC=C(C=C2)Br)C(=O)NC(C)C
InChI=1SC13H15BrN4Oc18(2)1513(19)129(3)18(171612)116410(14)5711h48H13H3(H1519)
MFCD09875313
ZINC000012274297
ZINC12274297

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.