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

Systemtic Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene-(ethylcarbamothioylamino)azanium Openeye Name: [3-ethoxy-4-(p-tolylmethoxy)phenyl]methylene-(ethylcarbamothioylamino)ammonium CAS Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene-[[ethylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene-(ethylcarbamothioylamino)azanium Traditional Name: [3-ethoxy-4-(4-methylbenzyl)oxy-benzylidene]-(ethylthiocarbamoylamino)ammonium Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S/c1-4-21-20(26)23-22-13-17-10-11-18(19(12-17)24-5-2)25-14-16-8-6-15(3)7-9-16/h6-13H,4-5,14H2,1-3H3,(H2,21,23,26)/p+1