Vitas-M small molecule compound

3-methyl-N-{2-[2-(methylcarbamothioyl)hydrazinyl]-2-oxoethyl}benzamide (non-preferred name)

Catalog ID
STK497574
SMILES CNC(=S)NNC(=O)CNC(=O)c1cccc(c1)C

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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 C12H16N4O2S MW 280.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O2S/c1-8-4-3-5-9(6-8)11(18)14-7-10(17)15-16-12(19)13-2/h3-6H,7H2,1-2H3,(H,14,18)(H,15,17)(H2,13,16,19)
InChIKey
SWPHKKKLJSPEPH-UHFFFAOYSA-N
Synonyms

3methylN(2(2(methylcarbamothioyl)hydrazinyl)2oxoethyl)benzamide
3methylN(2(2(methylcarbamothioyl)hydrazinyl)2oxoethyl)benzamide(nonpreferredname)
CC1=CC=CC(=C1)C(=O)NCC(=O)NNC(=S)NC
InChI=1SC12H16N4O2Sc184359(68)11(18)14710(17)151612(19)132h36H7H212H3(H1418)(H1517)(H2131619)
MFCD11854962
ZINC000032579319
ZINC32579319

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Available files

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