2-[[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethanethioyl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethanethioyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[2-(4-acetylanilino)-2-oxo-ethanethioyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-(4-acetylanilino)-2-oxo-1-sulfanylideneethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-(4-acetylanilino)-2-oxoethanethioyl]amino]ethyl-diethylazanium Traditional Name: 2-[[2-(4-acetylanilino)-2-keto-thioacetyl]amino]ethyl-diethyl-ammonium Formula: C16H24N3O2S+ MolecularWeight: 322.44566

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=S)C(=O)NC1=CC=C(C=C1)C(=O)C

Isomeric SMILES

CC[NH+](CC)CCNC(=S)C(=O)NC1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C16H23N3O2S/c1-4-19(5-2)11-10-17-16(22)15(21)18-14-8-6-13(7-9-14)12(3)20/h6-9H,4-5,10-11H2,1-3H3,(H,17,22)(H,18,21)/p+1