Vitas-M small molecule compound

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

Catalog ID
STK294485
SMILES CCCCOc1cccc(c1)C(=O)Nc1ccc(cc1C)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/c1-3-4-14-29-20-9-7-8-18(16-20)24(28)26-21-13-12-19(15-17(21)2)25-27-22-10-5-6-11-23(22)30-25/h5-13,15-16H,3-4,14H2,1-2H3,(H,26,28)
InChIKey
XVTABJBSYUHIMS-UHFFFAOYSA-N
Synonyms

CCCCOC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)C
InChI=1SC25H24N2O2Sc13414292097818(1620)24(28)2621131219(1517(21)2)25272210561123(22)3025h5131516H3414H212H3(H2628)
MFCD05850303
N(4(13benzothiazol2yl)2methylphenyl)3butoxybenzamide
ZINC000005978443
ZINC05978443
ZINC5978443

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Available files

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