Vitas-M small molecule compound

1-[4-(2-methylpropoxy)benzyl]thiourea

Catalog ID
STK542990
SMILES CC(COc1ccc(cc1)CNC(=S)N)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 C12H18N2OS MW 238.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N2OS/c1-9(2)8-15-11-5-3-10(4-6-11)7-14-12(13)16/h3-6,9H,7-8H2,1-2H3,(H3,13,14,16)
InChIKey
NUQHOQOFFJNITC-UHFFFAOYSA-N
Synonyms
37412-69-4
(4(2METHYLPROPOXY)PHENYL)METHYLTHIOUREA
1(4(2methylpropoxy)benzyl)thiourea
1(4isobutoxybenzyl)thiourea
37412694
CC(C)COC1=CC=C(C=C1)CNC(=S)N
InChI=1SC12H18N2OSc19(2)815115310(4611)71412(13)16h369H78H212H3(H3131416)
MFCD01902872
ZINC000000551916
ZINC00551916
ZINC551916

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Available files

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