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

Systemtic Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium Openeye Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxy-phenyl]methylene-(methylcarbamothioylamino)ammonium CAS Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene-[[methylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene-(methylcarbamothioylamino)azanium Traditional Name: [4-(3-chlorobenzyl)oxy-3-ethoxy-benzylidene]-(methylthiocarbamoylamino)ammonium Formula: C18H21ClN3O2S+ MolecularWeight: 378.89624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O2S/c1-3-23-17-10-13(11-21-22-18(25)20-2)7-8-16(17)24-12-14-5-4-6-15(19)9-14/h4-11H,3,12H2,1-2H3,(H2,20,22,25)/p+1