Vitas-M small molecule compound

tert-butyl 4-{[(4-fluorophenyl)carbonyl]carbamothioyl}piperazine-1-carboxylate

Catalog ID
STK448149
SMILES S=C(N1CCN(CC1)C(=O)OC(C)(C)C)NC(=O)c1ccc(cc1)F

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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 C17H22FN3O3S MW 367.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22FN3O3S/c1-17(2,3)24-16(23)21-10-8-20(9-11-21)15(25)19-14(22)12-4-6-13(18)7-5-12/h4-7H,8-11H2,1-3H3,(H,19,22,25)
InChIKey
OHLRSTYURGASGK-UHFFFAOYSA-N
Synonyms

CC(C)(C)OC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)F
InChI=1SC17H22FN3O3Sc117(23)2416(23)2110820(91121)15(25)1914(22)124613(18)7512h47H811H213H3(H192225)
MFCD04138136
tertbutyl4(((4fluorophenyl)carbonyl)carbamothioyl)piperazine1carboxylate
TERTBUTYL4(((4FLUOROPHENYL)CARBONYLAMINO)THIOXOMETHYL)PIPERAZINECARBOXYLATE
tertbutyl4((4fluorobenzoyl)carbamothioyl)piperazine1carboxylate
ZINC000006262592
ZINC06262592
ZINC6262592

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Available files

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