Vitas-M small molecule compound

1-(4-butylphenyl)-5-methyl-N-phenyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK950243
SMILES CCCCc1ccc(cc1)n1nnc(c1C)C(=O)Nc1ccccc1

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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 C20H22N4O MW 334.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O/c1-3-4-8-16-11-13-18(14-12-16)24-15(2)19(22-23-24)20(25)21-17-9-6-5-7-10-17/h5-7,9-14H,3-4,8H2,1-2H3,(H,21,25)
InChIKey
UKKXHPCJIYKFKW-UHFFFAOYSA-N
Synonyms
904813-77-0
(1(4BUTYLPHENYL)5METHYL(123TRIAZOL4YL))NBENZAMIDE
1(4butylphenyl)5methylNphenyl1H123triazole4carboxamide
1(4BUTYLPHENYL)5METHYLNPHENYLTRIAZOLE4CARBOXAMIDE
904813770
CCCCC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)NC3=CC=CC=C3)C
InChI=1SC20H22N4Oc134816111318(141216)2415(2)19(222324)20(25)211796571017h57914H348H212H3(H2125)
MFCD08543222
ZINC000008021982
ZINC08021982
ZINC8021982

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Available files

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