2-[[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(3-bromo-4-ethoxy-5-methoxybenzoyl)amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C15H24BrN4O3S+ MolecularWeight: 420.34506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NNC(=S)NCC[NH+](C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NNC(=S)NCC[NH+](C)C)OC

InChI

InChI=1S/C15H23BrN4O3S/c1-5-23-13-11(16)8-10(9-12(13)22-4)14(21)18-19-15(24)17-6-7-20(2)3/h8-9H,5-7H2,1-4H3,(H,18,21)(H2,17,19,24)/p+1