Vitas-M small molecule compound

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

Catalog ID
STK266201
SMILES COc1ccc(cc1NC(=S)NC(=O)C(C)(C)C)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 C20H21N3O2S2 MW 399.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S2/c1-20(2,3)18(24)23-19(26)22-14-11-12(9-10-15(14)25-4)17-21-13-7-5-6-8-16(13)27-17/h5-11H,1-4H3,(H2,22,23,24,26)
InChIKey
VKZXKOBQPSDHIS-UHFFFAOYSA-N
Synonyms

CC(C)(C)C(=O)NC(=S)NC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OC
InChI=1SC20H21N3O2S2c120(23)18(24)2319(26)22141112(91015(14)254)172113756816(13)2717h511H14H3(H222232426)
MFCD03864144
N((5(13benzothiazol2yl)2methoxyphenyl)carbamothioyl)22dimethylpropanamide
N(5(13BENZOTHIAZOL2YL)2METHOXYPHENYL)N(22DIMETHYLPROPANOYL)THIOUREA
ZINC000000679577
ZINC00679577
ZINC679577

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Available files

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