(3-ethoxy-4-phenylmethoxy-phenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OCC2=CC=CC=C2

InChI

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