1-(3-methylbutyl)-3-(3-methylsulfanylphenyl)urea

Systemtic Name: 1-(3-methylbutyl)-3-(3-methylsulfanylphenyl)urea Openeye Name: 1-isopentyl-3-(3-methylsulfanylphenyl)urea CAS Name: 1-(3-methylbutyl)-3-[3-(methylthio)phenyl]urea IUPAC Name: 1-(3-methylbutyl)-3-(3-methylsulfanylphenyl)urea Traditional Name: 1-isoamyl-3-[3-(methylthio)phenyl]urea Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC1=CC(=CC=C1)SC

Isomeric SMILES

CC(C)CCNC(=O)NC1=CC(=CC=C1)SC

InChI

InChI=1S/C13H20N2OS/c1-10(2)7-8-14-13(16)15-11-5-4-6-12(9-11)17-3/h4-6,9-10H,7-8H2,1-3H3,(H2,14,15,16)