[4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium

Systemtic Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium Openeye Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylene-(phenylcarbamothioylamino)ammonium CAS Name: [[anilino(sulfanylidene)methyl]amino]-[[4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene]ammonium IUPAC Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene-(phenylcarbamothioylamino)azanium Traditional Name: [4-(3-chlorobenzyl)oxy-3-ethoxy-benzylidene]-(phenylthiocarbamoylamino)ammonium Formula: C23H23ClN3O2S+ MolecularWeight: 440.96562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NC2=CC=CC=C2)OCC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NC2=CC=CC=C2)OCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H22ClN3O2S/c1-2-28-22-14-17(15-25-27-23(30)26-20-9-4-3-5-10-20)11-12-21(22)29-16-18-7-6-8-19(24)13-18/h3-15H,2,16H2,1H3,(H2,26,27,30)/p+1