(3-fluorophenyl)methyl N-cyano-N'-(3-fluorophenyl)carbamimidothioate

Systemtic Name: (3-fluorophenyl)methyl N-cyano-N'-(3-fluorophenyl)carbamimidothioate Openeye Name: 1-cyano-3-(3-fluorophenyl)-2-[(3-fluorophenyl)methyl]isothiourea CAS Name: N-cyano-N'-(3-fluorophenyl)carbamimidothioic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl N-cyano-N'-(3-fluorophenyl)carbamimidothioate Traditional Name: 1-cyano-2-(3-fluorobenzyl)-3-(3-fluorophenyl)isothiourea Formula: C15H11F2N3S MolecularWeight: 303.329746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CSC(=NC2=CC(=CC=C2)F)NC#N

Isomeric SMILES

C1=CC(=CC(=C1)F)CSC(=NC2=CC(=CC=C2)F)NC#N

InChI

InChI=1S/C15H11F2N3S/c16-12-4-1-3-11(7-12)9-21-15(19-10-18)20-14-6-2-5-13(17)8-14/h1-8H,9H2,(H,19,20)