Vitas-M small molecule compound

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

Catalog ID
STK389548
SMILES Cc1cc(ccc1NC(=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 C25H24N2OS MW 400.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2OS/c1-16-15-18(24-27-21-7-5-6-8-22(21)29-24)11-14-20(16)26-23(28)17-9-12-19(13-10-17)25(2,3)4/h5-15H,1-4H3,(H,26,28)
InChIKey
ITISSILKLDCCRT-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC25H24N2OSc1161518(242721756822(21)2924)111420(16)2623(28)1791219(131017)25(23)4h515H14H3(H2628)
MFCD03836246
N(4(13benzothiazol2yl)2methylphenyl)4tertbutylbenzamide
N(4BENZOTHIAZOL2YL2METHYLPHENYL)(4(TERTBUTYL)PHENYL)CARBOXAMIDE
ZINC000004554527
ZINC04554527
ZINC4554527

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Available files

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