2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(3-chloro-4-fluorophenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C11H16ClFN3S+ MolecularWeight: 276.781243

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C11H15ClFN3S/c1-16(2)6-5-14-11(17)15-8-3-4-10(13)9(12)7-8/h3-4,7H,5-6H2,1-2H3,(H2,14,15,17)/p+1