1-butyl-3-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]urea

Systemtic Name: 1-butyl-3-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]urea Openeye Name: 1-butyl-3-[[2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]acetyl]amino]urea CAS Name: 1-butyl-3-[[2-[(2-chloro-4-fluorophenyl)methylthio]-1-oxoethyl]amino]urea IUPAC Name: 1-butyl-3-[[2-[(2-chloro-4-fluorophenyl)methylsulfanyl]acetyl]amino]urea Traditional Name: 1-butyl-3-[[2-[(2-chloro-4-fluoro-benzyl)thio]acetyl]amino]urea Formula: C14H19ClFN3O2S MolecularWeight: 347.835963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NNC(=O)CSCC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CCCCNC(=O)NNC(=O)CSCC1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C14H19ClFN3O2S/c1-2-3-6-17-14(21)19-18-13(20)9-22-8-10-4-5-11(16)7-12(10)15/h4-5,7H,2-3,6,8-9H2,1H3,(H,18,20)(H2,17,19,21)