1-(4-butyl-2-methyl-phenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]urea

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]urea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-(2-furylmethylsulfanyl)ethyl]urea CAS Name: 1-(4-butyl-2-methylphenyl)-3-[2-(2-furanylmethylthio)ethyl]urea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-[2-(furan-2-ylmethylsulfanyl)ethyl]urea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-(2-furfurylthio)ethyl]urea Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)NCCSCC2=CC=CO2)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)NCCSCC2=CC=CO2)C

InChI

InChI=1S/C19H26N2O2S/c1-3-4-6-16-8-9-18(15(2)13-16)21-19(22)20-10-12-24-14-17-7-5-11-23-17/h5,7-9,11,13H,3-4,6,10,12,14H2,1-2H3,(H2,20,21,22)