[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-ethoxy-phenyl]methylene-(methylcarbamothioylamino)ammonium CAS Name: [4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methylidene-[[methylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methylidene-(methylcarbamothioylamino)azanium Traditional Name: [4-(2-chloro-6-fluoro-benzyl)oxy-3-ethoxy-benzylidene]-(methylthiocarbamoylamino)ammonium Formula: C18H20ClFN3O2S+ MolecularWeight: 396.886703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NC)OCC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NC)OCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C18H19ClFN3O2S/c1-3-24-17-9-12(10-22-23-18(26)21-2)7-8-16(17)25-11-13-14(19)5-4-6-15(13)20/h4-10H,3,11H2,1-2H3,(H2,21,23,26)/p+1