Vitas-M small molecule compound

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

Catalog ID
STK227713
SMILES COc1ccc(cc1)C(=O)n1nc(nc1NCc1ccccc1OC)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 C23H21N5O3 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O3/c1-30-19-11-9-16(10-12-19)22(29)28-23(25-15-17-6-3-4-8-20(17)31-2)26-21(27-28)18-7-5-13-24-14-18/h3-14H,15H2,1-2H3,(H,25,26,27)
InChIKey
PJWRQMJZWJFILN-UHFFFAOYSA-N
Synonyms

(4METHOXYPHENYL)(5((2METHOXYPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)METHANONE
(5((2METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)(4METHOXYPHENYL)METHANONE
COC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CC=C4OC
InChI=1SC23H21N5O3c1301911916(101219)22(29)2823(251517634820(17)312)2621(2728)187513241418h314H15H212H3(H252627)
MFCD07792145
ZINC000004732585
ZINC04732585
ZINC4732585

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Available files

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