Vitas-M small molecule compound

2-{[(4-fluorophenyl)(methylsulfonyl)amino]acetyl}-N-phenylhydrazinecarbothioamide (non-preferred name)

Catalog ID
STK984041
SMILES O=C(CN(S(=O)(=O)C)c1ccc(cc1)F)NNC(=S)Nc1ccccc1

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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 C16H17FN4O3S2 MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17FN4O3S2/c1-26(23,24)21(14-9-7-12(17)8-10-14)11-15(22)19-20-16(25)18-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,22)(H2,18,20,25)
InChIKey
NFMPKEIBVCXQKZ-UHFFFAOYSA-N
Synonyms
919741-79-0
1((2(4fluoroNmethylsulfonylanilino)acetyl)amino)3phenylthiourea
2(((4fluorophenyl)(methylsulfonyl)amino)acetyl)Nphenylhydrazinecarbothioamide(nonpreferredname)
2(2(N(4fluorophenyl)methylsulfonamido)acetyl)Nphenylhydrazinecarbothioamide
919741790
CS(=O)(=O)N(CC(=O)NNC(=S)NC1=CC=CC=C1)C2=CC=C(C=C2)F
InChI=1SC16H17FN4O3S2c126(2324)21(149712(17)81014)1115(22)192016(25)18135324613h210H11H21H3(H1922)(H2182025)
MFCD08750813
ZINC000009189582
ZINC09189582
ZINC9189582

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Available files

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