Vitas-M small molecule compound

N-{[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-methylbenzamide

Catalog ID
STK077704
SMILES S=C(NC(=O)c1ccccc1C)Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2Cl

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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 C26H18ClN3O2S MW 471.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClN3O2S/c1-15-6-2-3-7-17(15)24(31)30-26(33)28-16-12-13-23-22(14-16)29-25(32-23)20-10-4-9-19-18(20)8-5-11-21(19)27/h2-14H,1H3,(H2,28,30,31,33)
InChIKey
ARYGPPJLPGHWEJ-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC5=C4C=CC=C5Cl
InChI=1SC26H18ClN3O2Sc115623717(15)24(31)3026(33)281612132322(1416)2925(3223)2010491918(20)851121(19)27h214H1H3(H228303133)
MFCD03262210
N((2(5CHLORONAPHTHALEN1YL)13BENZOXAZOL5YL)CARBAMOTHIOYL)2METHYLBENZAMIDE
S=C(NC(=O)c1ccccc1C)Nc1ccc2c(c1)nc(o2)c1cccc2c1cccc2Cl
STK077704
ZINC000009635931
ZINC09635931
ZINC9635931

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Available files

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