1-[(4-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-carbamothioylphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-thiocarbamoylbenzyl)piperidin-1-ium-4-carboxamide Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C14H19N3OS/c15-13(18)11-5-7-17(8-6-11)9-10-1-3-12(4-2-10)14(16)19/h1-4,11H,5-9H2,(H2,15,18)(H2,16,19)/p+1