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

Systemtic Name: 2-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(3,4-dimethoxybenzoyl)amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(3,4-dimethoxybenzoyl)amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: dimethyl-[2-[(veratroylamino)thiocarbamoylamino]ethyl]ammonium Formula: C14H23N4O3S+ MolecularWeight: 327.42242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O3S/c1-18(2)8-7-15-14(22)17-16-13(19)10-5-6-11(20-3)12(9-10)21-4/h5-6,9H,7-8H2,1-4H3,(H,16,19)(H2,15,17,22)/p+1