Vitas-M small molecule compound

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

Catalog ID
STK389896
SMILES COc1ccc(cc1NC(=S)NC(=O)c1ccccc1C)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 C23H19N3O2S2 MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O2S2/c1-14-7-3-4-8-16(14)21(27)26-23(29)25-18-13-15(11-12-19(18)28-2)22-24-17-9-5-6-10-20(17)30-22/h3-13H,1-2H3,(H2,25,26,27,29)
InChIKey
XIFIPUCUWKCWTR-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4S3)OC
InChI=1SC23H19N3O2S2c114734816(14)21(27)2623(29)25181315(111219(18)282)2224179561020(17)3022h313H12H3(H225262729)
MFCD03836407
N(((5BENZOTHIAZOL2YL2METHOXYPHENYL)AMINO)THIOXOMETHYL)(2METHYLPHENYL)CARBOXAMIDE
N((5(13benzothiazol2yl)2methoxyphenyl)carbamothioyl)2methylbenzamide
ZINC000004122540
ZINC04122540
ZINC4122540

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Available files

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