[4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium

Systemtic Name: [4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium Openeye Name: [4-[(4-bromophenyl)methoxy]-3-methoxy-phenyl]methylene-(methylcarbamothioylamino)ammonium CAS Name: [4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylidene-[[methylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(4-bromophenyl)methoxy]-3-methoxyphenyl]methylidene-(methylcarbamothioylamino)azanium Traditional Name: [4-(4-bromobenzyl)oxy-3-methoxy-benzylidene]-(methylthiocarbamoylamino)ammonium Formula: C17H19BrN3O2S+ MolecularWeight: 409.32066

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N[NH+]=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)Br)OC

Isomeric SMILES

CNC(=S)N[NH+]=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C17H18BrN3O2S/c1-19-17(24)21-20-10-13-5-8-15(16(9-13)22-2)23-11-12-3-6-14(18)7-4-12/h3-10H,11H2,1-2H3,(H2,19,21,24)/p+1