[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylidene-(phenylcarbamothioylamino)azanium

Systemtic Name: [3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylidene-(phenylcarbamothioylamino)azanium Openeye Name: [3-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]methylene-(phenylcarbamothioylamino)ammonium CAS Name: [[anilino(sulfanylidene)methyl]amino]-[[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]ammonium IUPAC Name: [3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene-(phenylcarbamothioylamino)azanium Traditional Name: [3-(2-chloro-6-fluoro-benzyl)oxybenzylidene]-(phenylthiocarbamoylamino)ammonium Formula: C21H18ClFN3OS+ MolecularWeight: 414.903523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)N[NH+]=CC2=CC(=CC=C2)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N[NH+]=CC2=CC(=CC=C2)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H17ClFN3OS/c22-19-10-5-11-20(23)18(19)14-27-17-9-4-6-15(12-17)13-24-26-21(28)25-16-7-2-1-3-8-16/h1-13H,14H2,(H2,25,26,28)/p+1