1-[3,4-bis(fluoranyl)phenyl]-3-octyl-thiourea

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-3-octyl-thiourea Openeye Name: 1-(3,4-difluorophenyl)-3-octyl-thiourea CAS Name: 1-(3,4-difluorophenyl)-3-octylthiourea IUPAC Name: 1-(3,4-difluorophenyl)-3-octylthiourea Traditional Name: 1-(3,4-difluorophenyl)-3-octyl-thiourea Formula: C15H22F2N2S MolecularWeight: 300.410386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=S)NC1=CC(=C(C=C1)F)F

Isomeric SMILES

CCCCCCCCNC(=S)NC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C15H22F2N2S/c1-2-3-4-5-6-7-10-18-15(20)19-12-8-9-13(16)14(17)11-12/h8-9,11H,2-7,10H2,1H3,(H2,18,19,20)