3-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]propyl-diethyl-azanium

Systemtic Name: 3-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]propyl-diethyl-azanium Openeye Name: 3-[(2-chloro-4,6-dimethyl-phenyl)carbamothioylamino]propyl-diethyl-ammonium CAS Name: 3-[[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]amino]propyl-diethylammonium IUPAC Name: 3-[(2-chloro-4,6-dimethylphenyl)carbamothioylamino]propyl-diethylazanium Traditional Name: 3-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoylamino]propyl-diethyl-ammonium Formula: C16H27ClN3S+ MolecularWeight: 328.92368

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=S)NC1=C(C=C(C=C1Cl)C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=S)NC1=C(C=C(C=C1Cl)C)C

InChI

InChI=1S/C16H26ClN3S/c1-5-20(6-2)9-7-8-18-16(21)19-15-13(4)10-12(3)11-14(15)17/h10-11H,5-9H2,1-4H3,(H2,18,19,21)/p+1