[3-[(4-carbamothioylphenyl)amino]-3-oxidanylidene-propyl]-dipropyl-azanium

Systemtic Name: [3-[(4-carbamothioylphenyl)amino]-3-oxidanylidene-propyl]-dipropyl-azanium Openeye Name: [3-(4-carbamothioylanilino)-3-oxo-propyl]-dipropyl-ammonium CAS Name: [3-(4-carbamothioylanilino)-3-oxopropyl]-dipropylammonium IUPAC Name: [3-(4-carbamothioylanilino)-3-oxopropyl]-dipropylazanium Traditional Name: [3-keto-3-(4-thiocarbamoylanilino)propyl]-dipropyl-ammonium Formula: C16H26N3OS+ MolecularWeight: 308.46214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3OS/c1-3-10-19(11-4-2)12-9-15(20)18-14-7-5-13(6-8-14)16(17)21/h5-8H,3-4,9-12H2,1-2H3,(H2,17,21)(H,18,20)/p+1