Vitas-M small molecule compound

(4-methoxyphenyl){5-[(4-methylbenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}methanone

Catalog ID
STK227624
SMILES COc1ccc(cc1)C(=O)n1nc(nc1NCc1ccc(cc1)C)c1cccnc1

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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 C23H21N5O2 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O2/c1-16-5-7-17(8-6-16)14-25-23-26-21(19-4-3-13-24-15-19)27-28(23)22(29)18-9-11-20(30-2)12-10-18/h3-13,15H,14H2,1-2H3,(H,25,26,27)
InChIKey
IBTMPCAZWOZXKK-UHFFFAOYSA-N
Synonyms

(4METHOXYPHENYL)(5((4METHYLBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)METHANONE
(4METHOXYPHENYL)(5((4METHYLPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)METHANONE
CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=C(C=C3)OC)C4=CN=CC=C4
InChI=1SC23H21N5O2c1165717(8616)1425232621(194313241519)2728(23)22(29)1891120(302)121018h31315H14H212H3(H252627)
MFCD08671711
ZINC000004732451
ZINC04732451
ZINC4732451

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Available files

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