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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(3,4-dimethoxyphenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3,4-dimethoxyphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(3,4-dimethoxyphenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C13H21N3O2S/c1-16(2)8-7-14-13(19)15-10-5-6-11(17-3)12(9-10)18-4/h5-6,9H,7-8H2,1-4H3,(H2,14,15,19)/p+1