Vitas-M small molecule compound

N-[(6-methyl-2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]butanamide

Catalog ID
STK040219
SMILES CCCC(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccccc1

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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 C18H19N5OS MW 353.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5OS/c1-3-7-17(24)20-18(25)19-14-11-16-15(10-12(14)2)21-23(22-16)13-8-5-4-6-9-13/h4-6,8-11H,3,7H2,1-2H3,(H2,19,20,24,25)
InChIKey
NXMICPSNRUBDMA-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1C)C3=CC=CC=C3
CCCC(=O)NC(=S)Nc1cc2nn(nc2cc1C)c1ccccc1
InChI=1SC18H19N5OSc13717(24)2018(25)1914111615(1012(14)2)2123(2216)138546913h46811H37H212H3(H219202425)
MFCD03031978
N((6METHYL2PHENYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
N((6METHYL2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
STK040219
ZINC000001000659
ZINC01000659
ZINC1000659

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Available files

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