2-[(5-acetamido-2-methoxy-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-acetamido-2-methoxy-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-acetamido-2-methoxy-phenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(5-acetamido-2-methoxyanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-acetamido-2-methoxyphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(5-acetamido-2-methoxy-phenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C14H23N4O2S+ MolecularWeight: 311.42302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=S)NCC[NH+](C)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=S)NCC[NH+](C)C

InChI

InChI=1S/C14H22N4O2S/c1-10(19)16-11-5-6-13(20-4)12(9-11)17-14(21)15-7-8-18(2)3/h5-6,9H,7-8H2,1-4H3,(H,16,19)(H2,15,17,21)/p+1