3-[(4-acetamido-2,5-dimethoxy-phenyl)carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-acetamido-2,5-dimethoxy-phenyl)carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-acetamido-2,5-dimethoxy-phenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-acetamido-2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-acetamido-2,5-dimethoxyphenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(4-acetamido-2,5-dimethoxy-phenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C16H27N4O3S+ MolecularWeight: 355.47558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1OC)NC(=S)NCCC[NH+](C)C)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1OC)NC(=S)NCCC[NH+](C)C)OC

InChI

InChI=1S/C16H26N4O3S/c1-11(21)18-12-9-15(23-5)13(10-14(12)22-4)19-16(24)17-7-6-8-20(2)3/h9-10H,6-8H2,1-5H3,(H,18,21)(H2,17,19,24)/p+1