1-[3,4-bis(fluoranyl)phenyl]-3-(2,6-diethylphenyl)thiourea

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-3-(2,6-diethylphenyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(3,4-difluorophenyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-(3,4-difluorophenyl)thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(3,4-difluorophenyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-(3,4-difluorophenyl)thiourea Formula: C17H18F2N2S MolecularWeight: 320.400026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC(=C(C=C2)F)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C17H18F2N2S/c1-3-11-6-5-7-12(4-2)16(11)21-17(22)20-13-8-9-14(18)15(19)10-13/h5-10H,3-4H2,1-2H3,(H2,20,21,22)