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

Systemtic Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylidene-(ethylcarbamothioylamino)azanium Openeye Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylene-(ethylcarbamothioylamino)ammonium CAS Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene-[[ethylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene-(ethylcarbamothioylamino)azanium Traditional Name: [4-(3-chlorobenzyl)oxy-3-ethoxy-benzylidene]-(ethylthiocarbamoylamino)ammonium Formula: C19H23ClN3O2S+ MolecularWeight: 392.92282

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N[NH+]=CC1=CC(=C(C=C1)OCC2=CC(=CC=C2)Cl)OCC

Isomeric SMILES

CCNC(=S)N[NH+]=CC1=CC(=C(C=C1)OCC2=CC(=CC=C2)Cl)OCC

InChI

InChI=1S/C19H22ClN3O2S/c1-3-21-19(26)23-22-12-14-8-9-17(18(11-14)24-4-2)25-13-15-6-5-7-16(20)10-15/h5-12H,3-4,13H2,1-2H3,(H2,21,23,26)/p+1