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

Systemtic Name: 3-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-chloro-2,5-dimethoxyphenyl)carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C14H23ClN3O2S+ MolecularWeight: 332.86932

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)NC1=CC(=C(C=C1OC)Cl)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)NC1=CC(=C(C=C1OC)Cl)OC

InChI

InChI=1S/C14H22ClN3O2S/c1-18(2)7-5-6-16-14(21)17-11-9-12(19-3)10(15)8-13(11)20-4/h8-9H,5-7H2,1-4H3,(H2,16,17,21)/p+1