Vitas-M small molecule compound

N-butyl-1-phenyl-5-propyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STL018238
SMILES CCCc1c(nnn1c1ccccc1)C(=O)NCCCC

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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 C16H22N4O MW 286.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O/c1-3-5-12-17-16(21)15-14(9-4-2)20(19-18-15)13-10-7-6-8-11-13/h6-8,10-11H,3-5,9,12H2,1-2H3,(H,17,21)
InChIKey
TXOZKBDSKDWQFC-UHFFFAOYSA-N
Synonyms

CCCCNC(=O)C1=C(N(N=N1)C2=CC=CC=C2)CCC
InChI=1SC16H22N4Oc135121716(21)1514(942)20(191815)13107681113h681011H35912H212H3(H1721)
MFCD09875310
NBUTYL(1PHENYL5PROPYL(123TRIAZOL4YL))CARBOXAMIDE
Nbutyl1phenyl5propyl1H123triazole4carboxamide
Nbutyl1phenyl5propyltriazole4carboxamide
ZINC000012274790
ZINC12274790

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Available files

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