[3-[(2-carbamothioylphenyl)amino]-3-oxidanylidene-propyl]-diethyl-azanium

Systemtic Name: [3-[(2-carbamothioylphenyl)amino]-3-oxidanylidene-propyl]-diethyl-azanium Openeye Name: [3-(2-carbamothioylanilino)-3-oxo-propyl]-diethyl-ammonium CAS Name: [3-(2-carbamothioylanilino)-3-oxopropyl]-diethylammonium IUPAC Name: [3-(2-carbamothioylanilino)-3-oxopropyl]-diethylazanium Traditional Name: diethyl-[3-keto-3-(2-thiocarbamoylanilino)propyl]ammonium Formula: C14H22N3OS+ MolecularWeight: 280.40898

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(=O)NC1=CC=CC=C1C(=S)N

Isomeric SMILES

CC[NH+](CC)CCC(=O)NC1=CC=CC=C1C(=S)N

InChI

InChI=1S/C14H21N3OS/c1-3-17(4-2)10-9-13(18)16-12-8-6-5-7-11(12)14(15)19/h5-8H,3-4,9-10H2,1-2H3,(H2,15,19)(H,16,18)/p+1