(2-carbamothioylphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (2-carbamothioylphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: (2-carbamothioylphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: (2-carbamothioylphenyl)methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (2-carbamothioylphenyl)methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: methyl-(1-methylpiperidin-1-ium-4-yl)-(2-thiocarbamoylbenzyl)ammonium Formula: C15H25N3S+2 MolecularWeight: 279.4441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=CC=C2C(=S)N

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C15H23N3S/c1-17-9-7-13(8-10-17)18(2)11-12-5-3-4-6-14(12)15(16)19/h3-6,13H,7-11H2,1-2H3,(H2,16,19)/p+2