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

Systemtic Name: 1-butyl-3-[2-(furan-2-ylmethylsulfanyl)ethyl]urea Openeye Name: 1-butyl-3-[2-(2-furylmethylsulfanyl)ethyl]urea CAS Name: 1-butyl-3-[2-(2-furanylmethylthio)ethyl]urea IUPAC Name: 1-butyl-3-[2-(furan-2-ylmethylsulfanyl)ethyl]urea Traditional Name: 1-butyl-3-[2-(2-furfurylthio)ethyl]urea Formula: C12H20N2O2S MolecularWeight: 256.3644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCCSCC1=CC=CO1

Isomeric SMILES

CCCCNC(=O)NCCSCC1=CC=CO1

InChI

InChI=1S/C12H20N2O2S/c1-2-3-6-13-12(15)14-7-9-17-10-11-5-4-8-16-11/h4-5,8H,2-3,6-7,9-10H2,1H3,(H2,13,14,15)