3-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-[ethyl(isopropyl)amino]phenyl]carbamothioylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-[ethyl(propan-2-yl)amino]anilino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]propyl-dimethylazanium Traditional Name: 3-[[4-[ethyl(isopropyl)amino]phenyl]thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C17H31N4S+ MolecularWeight: 323.51984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC(=S)NCCC[NH+](C)C)C(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC(=S)NCCC[NH+](C)C)C(C)C

InChI

InChI=1S/C17H30N4S/c1-6-21(14(2)3)16-10-8-15(9-11-16)19-17(22)18-12-7-13-20(4)5/h8-11,14H,6-7,12-13H2,1-5H3,(H2,18,19,22)/p+1