3-[[(3-methoxy-4-propoxy-phenyl)carbonylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3-methoxy-4-propoxy-phenyl)carbonylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(3-methoxy-4-propoxy-benzoyl)amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(3-methoxy-4-propoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3-methoxy-4-propoxybenzoyl)amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(3-methoxy-4-propoxy-benzoyl)amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H29N4O3S+ MolecularWeight: 369.50216

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC[NH+](C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC[NH+](C)C)OC

InChI

InChI=1S/C17H28N4O3S/c1-5-11-24-14-8-7-13(12-15(14)23-4)16(22)19-20-17(25)18-9-6-10-21(2)3/h7-8,12H,5-6,9-11H2,1-4H3,(H,19,22)(H2,18,20,25)/p+1