bis(4-fluorophenyl)methyl N'-propylcarbamimidothioate

Systemtic Name: bis(4-fluorophenyl)methyl N'-propylcarbamimidothioate Openeye Name: 2-[bis(4-fluorophenyl)methyl]-3-propyl-isothiourea CAS Name: N'-propylcarbamimidothioic acid bis(4-fluorophenyl)methyl ester IUPAC Name: bis(4-fluorophenyl)methyl N'-propylcarbamimidothioate Traditional Name: 2-[bis(4-fluorophenyl)methyl]-3-propyl-isothiourea Formula: C17H18F2N2S MolecularWeight: 320.400026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18F2N2S/c1-2-11-21-17(20)22-16(12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-10,16H,2,11H2,1H3,(H2,20,21)