Vitas-M small molecule compound

1-(2-methylpropyl)-3-[2-(methylsulfanyl)phenyl]thiourea

Catalog ID
STL178553
SMILES CSc1ccccc1NC(=S)NCC(C)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 C12H18N2S2 MW 254.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N2S2/c1-9(2)8-13-12(15)14-10-6-4-5-7-11(10)16-3/h4-7,9H,8H2,1-3H3,(H2,13,14,15)
InChIKey
IICLZDSUBIKPHO-UHFFFAOYSA-N
Synonyms
827593-51-1
1(2methylpropyl)3(2(methylsulfanyl)phenyl)thiourea
1(2methylpropyl)3(2methylsulfanylphenyl)thiourea
827593511
CC(C)CNC(=S)NC1=CC=CC=C1SC
InChI=1SC12H18N2S2c19(2)81312(15)1410645711(10)163h479H8H213H3(H2131415)
MFCD05666876
ZINC000002777844
ZINC02777844
ZINC2777844

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Available files

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