Vitas-M small molecule compound

1-(4-tert-butylbenzyl)-N-[(E)-(4,8-dimethoxynaphthalen-1-yl)methylidene]-1H-benzimidazol-2-amine

Catalog ID
STK498235
SMILES COc1ccc(c2c1cccc2OC)/C=N/c1nc2c(n1Cc1ccc(cc1)C(C)(C)C)cccc2

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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 C31H31N3O2 MW 477.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O2/c1-31(2,3)23-16-13-21(14-17-23)20-34-26-11-7-6-10-25(26)33-30(34)32-19-22-15-18-27(35-4)24-9-8-12-28(36-5)29(22)24/h6-19H,20H2,1-5H3/b32-19+
InChIKey
MEWMBAYHOUHNGU-BIZUNTBRSA-N
Synonyms

(E)N(1((4tertbutylphenyl)methyl)benzimidazol2yl)1(48dimethoxynaphthalen1yl)methanimine
1(4tertbutylbenzyl)N((E)(48dimethoxynaphthalen1yl)methylidene)1Hbenzimidazol2amine
CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2N=CC4=C5C(=C(C=C4)OC)C=CC=C5OC
COc1ccc(c2c1cccc2OC)C=Nc1nc2c(n1Cc1ccc(cc1)C(C)(C)C)cccc2
InChI=1SC31H31N3O2c131(23)23161321(141723)20342611761025(26)3330(34)321922151827(354)24981228(365)29(22)24h619H20H215H3b3219+
MFCD01055055
ZINC000001878602

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Available files

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