Vitas-M small molecule compound

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

Catalog ID
STK227590
SMILES COc1ccc(cc1)CNc1nc(nn1C(=O)c1ccc(cc1)C(C)(C)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 C26H27N5O2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2/c1-26(2,3)21-11-9-19(10-12-21)24(32)31-25(28-16-18-7-13-22(33-4)14-8-18)29-23(30-31)20-6-5-15-27-17-20/h5-15,17H,16H2,1-4H3,(H,28,29,30)
InChIKey
KYTOOAKUADAIHQ-UHFFFAOYSA-N
Synonyms

(4TERTBUTYLPHENYL)(5((4METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)METHANONE
(4TERTBUTYLPHENYL)(5((4METHOXYPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)METHANONE
CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)OC
InChI=1SC26H27N5O2c126(23)2111919(101221)24(32)3125(28161871322(334)14818)2923(3031)206515271720h51517H16H214H3(H282930)
MFCD08671645
ZINC000009195239
ZINC09195239
ZINC9195239

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Available files

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