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

Systemtic Name: N-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-yl)carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-yl)thiocarbamoyl]cyclopropanecarboxamide Formula: C17H24N3OS+ MolecularWeight: 318.45696

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC(=S)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C1CC1C(=O)NC(=S)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N3OS/c21-16(14-6-7-14)19-17(22)18-15-8-10-20(11-9-15)12-13-4-2-1-3-5-13/h1-5,14-15H,6-12H2,(H2,18,19,21,22)/p+1