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

Systemtic Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]methylidene-(ethylcarbamothioylamino)azanium Openeye Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxy-phenyl]methylene-(ethylcarbamothioylamino)ammonium CAS Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]methylidene-[[ethylamino(sulfanylidene)methyl]amino]ammonium IUPAC Name: [4-[(4-tert-butylphenyl)methoxy]-3-methoxyphenyl]methylidene-(ethylcarbamothioylamino)azanium Traditional Name: [4-(4-tert-butylbenzyl)oxy-3-methoxy-benzylidene]-(ethylthiocarbamoylamino)ammonium Formula: C22H30N3O2S+ MolecularWeight: 400.5575

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2S/c1-6-23-21(28)25-24-14-17-9-12-19(20(13-17)26-5)27-15-16-7-10-18(11-8-16)22(2,3)4/h7-14H,6,15H2,1-5H3,(H2,23,25,28)/p+1