2-[(5-chloranyl-2-phenylsulfanyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-chloranyl-2-phenylsulfanyl-phenyl)carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-chloro-2-phenylsulfanyl-phenyl)carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-chloro-2-(phenylthio)anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-chloro-2-phenylsulfanylphenyl)carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-chloro-2-(phenylthio)phenyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H21ClN3S2+ MolecularWeight: 366.95174

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=C(C=CC(=C1)Cl)SC2=CC=CC=C2

InChI

InChI=1S/C17H20ClN3S2/c1-21(2)11-10-19-17(22)20-15-12-13(18)8-9-16(15)23-14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3,(H2,19,20,22)/p+1