Vitas-M small molecule compound

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

Catalog ID
STK389897
SMILES COc1c(C)cccc1C(=O)NC(=S)Nc1ccccc1c1nc2c(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/c1-14-8-7-10-16(20(14)28-2)21(27)26-23(29)25-17-11-4-3-9-15(17)22-24-18-12-5-6-13-19(18)30-22/h3-13H,1-2H3,(H2,25,26,27,29)
InChIKey
TUHNNZWRWOPEGV-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3
InChI=1SC23H19N3O2S2c114871016(20(14)282)21(27)2623(29)25171143915(17)22241812561319(18)3022h313H12H3(H225262729)
MFCD04041364
N(((2BENZOTHIAZOL2YLPHENYL)AMINO)THIOXOMETHYL)(2METHOXY3METHYLPHENYL)CARBOXAMIDE
N((2(13benzothiazol2yl)phenyl)carbamothioyl)2methoxy3methylbenzamide
ZINC000002882912
ZINC02882912
ZINC2882912

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Available files

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