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

Systemtic Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]methylidene-(methylcarbamothioylamino)azanium Openeye Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]methylene-(methylcarbamothioylamino)ammonium CAS Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]methylidene-[[methylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]methylidene-(methylcarbamothioylamino)azanium Traditional Name: [4-(4-tert-butylbenzyl)oxy-3-methoxy-benzylidene]-(methylthiocarbamoylamino)ammonium Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=[NH+]NC(=S)NC)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=[NH+]NC(=S)NC)OC

InChI

InChI=1S/C21H27N3O2S/c1-21(2,3)17-9-6-15(7-10-17)14-26-18-11-8-16(12-19(18)25-5)13-23-24-20(27)22-4/h6-13H,14H2,1-5H3,(H2,22,24,27)/p+1