2-[(2,5-dimethylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(2,5-dimethylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(2,5-dimethylphenyl)carbamothioyl-(2-thienylmethyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[(2,5-dimethylanilino)-sulfanylidenemethyl]-(thiophen-2-ylmethyl)amino]ethyl-diethylammonium IUPAC Name: 2-[(2,5-dimethylphenyl)carbamothioyl-(thiophen-2-ylmethyl)amino]ethyl-diethylazanium Traditional Name: 2-[(2,5-dimethylphenyl)thiocarbamoyl-(2-thenyl)amino]ethyl-diethyl-ammonium Formula: C20H30N3S2+ MolecularWeight: 376.6023

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC1=CC=CS1)C(=S)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CC[NH+](CC)CCN(CC1=CC=CS1)C(=S)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H29N3S2/c1-5-22(6-2)11-12-23(15-18-8-7-13-25-18)20(24)21-19-14-16(3)9-10-17(19)4/h7-10,13-14H,5-6,11-12,15H2,1-4H3,(H,21,24)/p+1