3-[[(3-methoxy-4-propan-2-yloxy-phenyl)carbonylamino]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3-methoxy-4-propan-2-yloxy-phenyl)carbonylamino]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-isopropoxy-3-methoxy-benzoyl)amino]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(3-methoxy-4-propan-2-yloxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3-methoxy-4-propan-2-yloxybenzoyl)amino]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[(4-isopropoxy-3-methoxy-benzoyl)amino]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H29N4O3S+ MolecularWeight: 369.50216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC[NH+](C)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NNC(=S)NCCC[NH+](C)C)OC

InChI

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