Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-4-tert-butylbenzamide

Catalog ID
STK294468
SMILES COc1ccc(cc1NC(=O)c1ccc(cc1)C(C)(C)C)c1nc2c(s1)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 C25H24N2O2S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O2S/c1-25(2,3)18-12-9-16(10-13-18)23(28)26-20-15-17(11-14-21(20)29-4)24-27-19-7-5-6-8-22(19)30-24/h5-15H,1-4H3,(H,26,28)
InChIKey
HAPNLLLATAGQKJ-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4S3)OC
InChI=1SC25H24N2O2Sc125(23)1812916(101318)23(28)26201517(111421(20)294)242719756822(19)3024h515H14H3(H2628)
MFCD05850208
N(5(13benzothiazol2yl)2methoxyphenyl)4tertbutylbenzamide
ZINC000013946057
ZINC13946057

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Available files

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