bis(4-fluorophenyl)methyl N'-ethylcarbamimidothioate

Systemtic Name: bis(4-fluorophenyl)methyl N'-ethylcarbamimidothioate Openeye Name: 2-[bis(4-fluorophenyl)methyl]-3-ethyl-isothiourea CAS Name: N'-ethylcarbamimidothioic acid bis(4-fluorophenyl)methyl ester IUPAC Name: bis(4-fluorophenyl)methyl N'-ethylcarbamimidothioate Traditional Name: 2-[bis(4-fluorophenyl)methyl]-3-ethyl-isothiourea Formula: C16H16F2N2S MolecularWeight: 306.373446

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N)SC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F

Isomeric SMILES

CCN=C(N)SC(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H16F2N2S/c1-2-20-16(19)21-15(11-3-7-13(17)8-4-11)12-5-9-14(18)10-6-12/h3-10,15H,2H2,1H3,(H2,19,20)