[4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium

Systemtic Name: [4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium Openeye Name: [4-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylene-(phenylcarbamothioylamino)ammonium CAS Name: [[anilino(sulfanylidene)methyl]amino]-[[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene]ammonium IUPAC Name: [4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene-(phenylcarbamothioylamino)azanium Traditional Name: [4-(2-fluorobenzyl)oxy-3-methoxy-benzylidene]-(phenylthiocarbamoylamino)ammonium Formula: C22H21FN3O2S+ MolecularWeight: 410.484443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NC2=CC=CC=C2)OCC3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NC2=CC=CC=C2)OCC3=CC=CC=C3F

InChI

InChI=1S/C22H20FN3O2S/c1-27-21-13-16(14-24-26-22(29)25-18-8-3-2-4-9-18)11-12-20(21)28-15-17-7-5-6-10-19(17)23/h2-14H,15H2,1H3,(H2,25,26,29)/p+1