2-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(4-chlorophenyl)-2-furyl]methylcarbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[5-(4-chlorophenyl)-2-furanyl]methylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-(4-chlorophenyl)-2-furyl]methylthiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C16H21ClN3OS+ MolecularWeight: 338.87544

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCC1=CC=C(O1)C2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+](C)CCNC(=S)NCC1=CC=C(O1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClN3OS/c1-20(2)10-9-18-16(22)19-11-14-7-8-15(21-14)12-3-5-13(17)6-4-12/h3-8H,9-11H2,1-2H3,(H2,18,19,22)/p+1