2-[[4-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzoyl]amino]ethyl-diethyl-ammonium Formula: C23H30N3O2S2+ MolecularWeight: 444.6332

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C23H29N3O2S2/c1-3-26(4-2)14-13-24-21(27)17-9-11-20(12-10-17)25-22(28)18-5-7-19(8-6-18)23-29-15-16-30-23/h5-12,23H,3-4,13-16H2,1-2H3,(H,24,27)(H,25,28)/p+1