[4-[(2-carbamothioylphenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium

Systemtic Name: [4-[(2-carbamothioylphenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-(2-carbamothioylanilino)-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-(2-carbamothioylanilino)-4-oxobutyl]-dimethylammonium IUPAC Name: [4-(2-carbamothioylanilino)-4-oxobutyl]-dimethylazanium Traditional Name: [4-keto-4-(2-thiocarbamoylanilino)butyl]-dimethyl-ammonium Formula: C13H20N3OS+ MolecularWeight: 266.3824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3OS/c1-16(2)9-5-8-12(17)15-11-7-4-3-6-10(11)13(14)18/h3-4,6-7H,5,8-9H2,1-2H3,(H2,14,18)(H,15,17)/p+1