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

Systemtic Name: N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamothioyl]propanamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]propanamide CAS Name: N-[[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]propanamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-yl)thiocarbamoyl]propionamide Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3OS/c1-2-15(20)18-16(21)17-14-8-10-19(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H2,17,18,20,21)/p+1