Vitas-M small molecule compound

N-{[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-2-methoxybenzamide

Catalog ID
STK040792
SMILES COc1ccccc1C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(o1)ccc(c2)Cl

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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 C23H18ClN3O3S MW 451.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O3S/c1-13-15(22-25-18-12-14(24)10-11-20(18)30-22)7-5-8-17(13)26-23(31)27-21(28)16-6-3-4-9-19(16)29-2/h3-12H,1-2H3,(H2,26,27,28,31)
InChIKey
VFWHUICOJGVIOH-UHFFFAOYSA-N
Synonyms
6408-60-2
6408602
CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC=C2OC)C3=NC4=C(O3)C=CC(=C4)Cl
COc1ccccc1C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(o1)ccc(c2)Cl
InChI=1SC23H18ClN3O3Sc11315(2225181214(24)101120(18)3022)75817(13)2623(31)2721(28)16634919(16)292h312H12H3(H226272831)
MFCD02578341
N((3(5CHLORO13BENZOXAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
N((3(5CHLOROBENZOOXAZOL2YL)2METHYLPHENYL)THIOCARBAMOYL)2METHOXYBENZAMIDE
N(3(5CHLORO13BENZOXAZOL2YL)2METHYLPHENYL)N(2METHOXYBENZOYL)THIOUREA
STK040792
ZINC000002064420
ZINC02064420
ZINC2064420

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Available files

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