[4-(4-chlorophenyl)carbonyloxy-3-methoxy-phenyl]methylidene-(prop-2-enylcarbamothioylamino)azanium

Systemtic Name: [4-(4-chlorophenyl)carbonyloxy-3-methoxy-phenyl]methylidene-(prop-2-enylcarbamothioylamino)azanium Openeye Name: (allylcarbamothioylamino)-[[4-(4-chlorobenzoyl)oxy-3-methoxy-phenyl]methylene]ammonium CAS Name: [4-[(4-chlorophenyl)-oxomethoxy]-3-methoxyphenyl]methylidene-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]ammonium IUPAC Name: [4-(4-chlorobenzoyl)oxy-3-methoxyphenyl]methylidene-(prop-2-enylcarbamothioylamino)azanium Traditional Name: (allylthiocarbamoylamino)-[4-(4-chlorobenzoyl)oxy-3-methoxy-benzylidene]ammonium Formula: C19H19ClN3O3S+ MolecularWeight: 404.89046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=[NH+]NC(=S)NCC=C)OC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-3-10-21-19(27)23-22-12-13-4-9-16(17(11-13)25-2)26-18(24)14-5-7-15(20)8-6-14/h3-9,11-12H,1,10H2,2H3,(H2,21,23,27)/p+1