N-(4-carbamothioylphenyl)-3-(4-methylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: N-(4-carbamothioylphenyl)-3-(4-methylpiperidin-1-ium-1-yl)propanamide Openeye Name: N-(4-carbamothioylphenyl)-3-(4-methylpiperidin-1-ium-1-yl)propanamide CAS Name: N-(4-carbamothioylphenyl)-3-(4-methyl-1-piperidin-1-iumyl)propanamide IUPAC Name: N-(4-carbamothioylphenyl)-3-(4-methylpiperidin-1-ium-1-yl)propanamide Traditional Name: 3-(4-methylpiperidin-1-ium-1-yl)-N-(4-thiocarbamoylphenyl)propionamide Formula: C16H24N3OS+ MolecularWeight: 306.44626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CC1CC[NH+](CC1)CCC(=O)NC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C16H23N3OS/c1-12-6-9-19(10-7-12)11-8-15(20)18-14-4-2-13(3-5-14)16(17)21/h2-5,12H,6-11H2,1H3,(H2,17,21)(H,18,20)/p+1