1-(4-bromanyl-2-methyl-phenyl)-3-(2-tert-butylsulfanylethyl)urea

Systemtic Name: 1-(4-bromanyl-2-methyl-phenyl)-3-(2-tert-butylsulfanylethyl)urea Openeye Name: 1-(4-bromo-2-methyl-phenyl)-3-(2-tert-butylsulfanylethyl)urea CAS Name: 1-(4-bromo-2-methylphenyl)-3-[2-(tert-butylthio)ethyl]urea IUPAC Name: 1-(4-bromo-2-methylphenyl)-3-(2-tert-butylsulfanylethyl)urea Traditional Name: 1-(4-bromo-2-methyl-phenyl)-3-[2-(tert-butylthio)ethyl]urea Formula: C14H21BrN2OS MolecularWeight: 345.29834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)NCCSC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)NCCSC(C)(C)C

InChI

InChI=1S/C14H21BrN2OS/c1-10-9-11(15)5-6-12(10)17-13(18)16-7-8-19-14(2,3)4/h5-6,9H,7-8H2,1-4H3,(H2,16,17,18)