1-[3,5-bis(fluoranyl)phenyl]-3-butyl-thiourea

Systemtic Name: 1-[3,5-bis(fluoranyl)phenyl]-3-butyl-thiourea Openeye Name: 1-butyl-3-(3,5-difluorophenyl)thiourea CAS Name: 1-butyl-3-(3,5-difluorophenyl)thiourea IUPAC Name: 1-butyl-3-(3,5-difluorophenyl)thiourea Traditional Name: 1-butyl-3-(3,5-difluorophenyl)thiourea Formula: C11H14F2N2S MolecularWeight: 244.304066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC(=CC(=C1)F)F

Isomeric SMILES

CCCCNC(=S)NC1=CC(=CC(=C1)F)F

InChI

InChI=1S/C11H14F2N2S/c1-2-3-4-14-11(16)15-10-6-8(12)5-9(13)7-10/h5-7H,2-4H2,1H3,(H2,14,15,16)