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

Systemtic Name: [4-[(4-carbamothioylphenyl)amino]-4-oxidanylidene-butyl]-dimethyl-azanium Openeye Name: [4-(4-carbamothioylanilino)-4-oxo-butyl]-dimethyl-ammonium CAS Name: [4-(4-carbamothioylanilino)-4-oxobutyl]-dimethylammonium IUPAC Name: [4-(4-carbamothioylanilino)-4-oxobutyl]-dimethylazanium Traditional Name: [4-keto-4-(4-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=C(C=C1)C(=S)N

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3OS/c1-16(2)9-3-4-12(17)15-11-7-5-10(6-8-11)13(14)18/h5-8H,3-4,9H2,1-2H3,(H2,14,18)(H,15,17)/p+1