1-(2,2-dimethylpropyl)-3-(2-methylsulfanylphenyl)urea

Systemtic Name: 1-(2,2-dimethylpropyl)-3-(2-methylsulfanylphenyl)urea Openeye Name: 1-(2,2-dimethylpropyl)-3-(2-methylsulfanylphenyl)urea CAS Name: 1-(2,2-dimethylpropyl)-3-[2-(methylthio)phenyl]urea IUPAC Name: 1-(2,2-dimethylpropyl)-3-(2-methylsulfanylphenyl)urea Traditional Name: 1-[2-(methylthio)phenyl]-3-neopentyl-urea Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)NC1=CC=CC=C1SC

Isomeric SMILES

CC(C)(C)CNC(=O)NC1=CC=CC=C1SC

InChI

InChI=1S/C13H20N2OS/c1-13(2,3)9-14-12(16)15-10-7-5-6-8-11(10)17-4/h5-8H,9H2,1-4H3,(H2,14,15,16)