2-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-(homoveratrylthiocarbamoylamino)ethyl-dimethyl-ammonium Formula: C15H26N3O2S+ MolecularWeight: 312.45084

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

C[NH+](C)CCNC(=S)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C15H25N3O2S/c1-18(2)10-9-17-15(21)16-8-7-12-5-6-13(19-3)14(11-12)20-4/h5-6,11H,7-10H2,1-4H3,(H2,16,17,21)/p+1