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

Systemtic Name: [4-[(2-carbamothioylphenyl)amino]-4-oxidanylidene-butyl]-diethyl-azanium Openeye Name: [4-(2-carbamothioylanilino)-4-oxo-butyl]-diethyl-ammonium CAS Name: [4-(2-carbamothioylanilino)-4-oxobutyl]-diethylammonium IUPAC Name: [4-(2-carbamothioylanilino)-4-oxobutyl]-diethylazanium Traditional Name: diethyl-[4-keto-4-(2-thiocarbamoylanilino)butyl]ammonium Formula: C15H24N3OS+ MolecularWeight: 294.43556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3OS/c1-3-18(4-2)11-7-10-14(19)17-13-9-6-5-8-12(13)15(16)20/h5-6,8-9H,3-4,7,10-11H2,1-2H3,(H2,16,20)(H,17,19)/p+1