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

Systemtic Name: (3-methoxy-4-pentoxy-phenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium Openeye Name: (allylcarbamothioylamino)-[(3-methoxy-4-pentoxy-phenyl)methylene]ammonium CAS Name: (3-methoxy-4-pentoxyphenyl)methylidene-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]ammonium IUPAC Name: (3-methoxy-4-pentoxyphenyl)methylidene-(prop-2-enylcarbamothioylamino)azanium Traditional Name: (allylthiocarbamoylamino)-(4-amoxy-3-methoxy-benzylidene)ammonium Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=[NH+]NC(=S)NCC=C)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C=[NH+]NC(=S)NCC=C)OC

InChI

InChI=1S/C17H25N3O2S/c1-4-6-7-11-22-15-9-8-14(12-16(15)21-3)13-19-20-17(23)18-10-5-2/h5,8-9,12-13H,2,4,6-7,10-11H2,1,3H3,(H2,18,20,23)/p+1