(3-methoxy-4-phenethyloxy-phenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium

Systemtic Name: (3-methoxy-4-phenethyloxy-phenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium Openeye Name: (allylcarbamothioylamino)-[(3-methoxy-4-phenethyloxy-phenyl)methylene]ammonium CAS Name: (3-methoxy-4-phenethyloxyphenyl)methylidene-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]ammonium IUPAC Name: (3-methoxy-4-phenethyloxyphenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium Traditional Name: (allylthiocarbamoylamino)-(3-methoxy-4-phenethyloxy-benzylidene)ammonium Formula: C20H24N3O2S+ MolecularWeight: 370.48846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OCCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2S/c1-3-12-21-20(26)23-22-15-17-9-10-18(19(14-17)24-2)25-13-11-16-7-5-4-6-8-16/h3-10,14-15H,1,11-13H2,2H3,(H2,21,23,26)/p+1