Vitas-M small molecule compound

N-[2-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-methoxybenzamide

Catalog ID
STK757640
SMILES CCc1ccc(cc1)NC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1OC

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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 C25H23N3O3S2 MW 477.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3S2/c1-3-16-8-10-17(11-9-16)26-23(29)15-32-25-28-20-13-12-18(14-22(20)33-25)27-24(30)19-6-4-5-7-21(19)31-2/h4-14H,3,15H2,1-2H3,(H,26,29)(H,27,30)
InChIKey
SIIUMQJICKSRJE-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4OC
InChI=1SC25H23N3O3S2c131681017(11916)2623(29)1532252820131218(1422(20)3325)2724(30)19645721(19)312h414H315H212H3(H2629)(H2730)
MFCD01234918
N(2((2((4ethylphenyl)amino)2oxoethyl)sulfanyl)13benzothiazol6yl)2methoxybenzamide
N(2(2(4ethylanilino)2oxoethyl)sulfanyl13benzothiazol6yl)2methoxybenzamide
ZINC000001059847
ZINC01059847
ZINC1059847

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Available files

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