2-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamothioyl]propanamide

Systemtic Name: 2-methyl-N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamothioyl]propanamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]-2-methyl-propanamide CAS Name: 2-methyl-N-[[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-yl)thiocarbamoyl]-2-methyl-propionamide Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H25N3OS/c1-13(2)16(21)19-17(22)18-15-8-10-20(11-9-15)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H2,18,19,21,22)/p+1