2-[(3-methoxyphenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-methoxyphenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(3-methoxyphenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3-methoxyphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(3-methoxyphenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C12H20N3OS+ MolecularWeight: 254.3717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3OS/c1-15(2)8-7-13-12(17)14-10-5-4-6-11(9-10)16-3/h4-6,9H,7-8H2,1-3H3,(H2,13,14,17)/p+1