Vitas-M small molecule compound

1-(4-butylphenyl)-3-(4-fluorobenzyl)thiourea

Catalog ID
STK143476
SMILES CCCCc1ccc(cc1)NC(=S)NCc1ccc(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 C18H21FN2S MW 316.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21FN2S/c1-2-3-4-14-7-11-17(12-8-14)21-18(22)20-13-15-5-9-16(19)10-6-15/h5-12H,2-4,13H2,1H3,(H2,20,21,22)
InChIKey
KIJWGKDATDQTKE-UHFFFAOYSA-N
Synonyms

((4BUTYLPHENYL)AMINO)(((4FLUOROPHENYL)METHYL)AMINO)METHANE1THIONE
1(4BUTYLPHENYL)3((4FLUOROPHENYL)METHYL)THIOUREA
1(4BUTYLPHENYL)3(4FLUOROBENZYL)THIOUREA
CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)F
InChI=1SC18H21FN2Sc12341471117(12814)2118(22)2013155916(19)10615h512H2413H21H3(H2202122)
MFCD03352288
ZINC000002836896
ZINC02836896
ZINC2836896

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Available files

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