2-[(5-chloranyl-2-piperidin-1-yl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-chloranyl-2-piperidin-1-yl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-chloro-2-(1-piperidyl)phenyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-chloro-2-piperidin-1-ylphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[(5-chloro-2-piperidino-phenyl)thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H26ClN4S+ MolecularWeight: 341.92244

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=C(C=CC(=C1)Cl)N2CCCCC2

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=C(C=CC(=C1)Cl)N2CCCCC2

InChI

InChI=1S/C16H25ClN4S/c1-20(2)11-8-18-16(22)19-14-12-13(17)6-7-15(14)21-9-4-3-5-10-21/h6-7,12H,3-5,8-11H2,1-2H3,(H2,18,19,22)/p+1