3-[2,5-bis(fluoranyl)phenyl]-1-(2,2-diethoxyethyl)-1-phenethyl-thiourea

Systemtic Name: 3-[2,5-bis(fluoranyl)phenyl]-1-(2,2-diethoxyethyl)-1-phenethyl-thiourea Openeye Name: 1-(2,2-diethoxyethyl)-3-(2,5-difluorophenyl)-1-phenethyl-thiourea CAS Name: 1-(2,2-diethoxyethyl)-3-(2,5-difluorophenyl)-1-phenethylthiourea IUPAC Name: 1-(2,2-diethoxyethyl)-3-(2,5-difluorophenyl)-1-phenethylthiourea Traditional Name: 1-(2,2-diethoxyethyl)-3-(2,5-difluorophenyl)-1-phenethyl-thiourea Formula: C21H26F2N2O2S MolecularWeight: 408.505146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN(CCC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)F)F)OCC

Isomeric SMILES

CCOC(CN(CCC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)F)F)OCC

InChI

InChI=1S/C21H26F2N2O2S/c1-3-26-20(27-4-2)15-25(13-12-16-8-6-5-7-9-16)21(28)24-19-14-17(22)10-11-18(19)23/h5-11,14,20H,3-4,12-13,15H2,1-2H3,(H,24,28)