2-[[[4-(diethylamino)phenyl]-(thiophen-2-ylmethyl)carbamothioyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[[4-(diethylamino)phenyl]-(thiophen-2-ylmethyl)carbamothioyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[[4-(diethylamino)phenyl]-(2-thienylmethyl)carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-(diethylamino)-N-(thiophen-2-ylmethyl)anilino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[4-(diethylamino)phenyl]-(thiophen-2-ylmethyl)carbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[[4-(diethylamino)phenyl]-(2-thenyl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C20H31N4S2+ MolecularWeight: 391.61694

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N(CC2=CC=CS2)C(=S)NCC[NH+](C)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N(CC2=CC=CS2)C(=S)NCC[NH+](C)C

InChI

InChI=1S/C20H30N4S2/c1-5-23(6-2)17-9-11-18(12-10-17)24(16-19-8-7-15-26-19)20(25)21-13-14-22(3)4/h7-12,15H,5-6,13-14,16H2,1-4H3,(H,21,25)/p+1