[4-[(3,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium

Systemtic Name: [4-[(3,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]methylidene-(phenylcarbamothioylamino)azanium Openeye Name: [4-[(3,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]methylene-(phenylcarbamothioylamino)ammonium CAS Name: [[anilino(sulfanylidene)methyl]amino]-[[4-[(3,4-dichlorophenyl)methoxy]-3-methoxyphenyl]methylidene]ammonium IUPAC Name: [4-[(3,4-dichlorophenyl)methoxy]-3-methoxyphenyl]methylidene-(phenylcarbamothioylamino)azanium Traditional Name: [4-(3,4-dichlorobenzyl)oxy-3-methoxy-benzylidene]-(phenylthiocarbamoylamino)ammonium Formula: C22H20Cl2N3O2S+ MolecularWeight: 461.3841

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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(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NC2=CC=CC=C2)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H19Cl2N3O2S/c1-28-21-12-15(13-25-27-22(30)26-17-5-3-2-4-6-17)8-10-20(21)29-14-16-7-9-18(23)19(24)11-16/h2-13H,14H2,1H3,(H2,26,27,30)/p+1