1-[(3-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-carbamothioylphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-carbamothioylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-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=CC(=C2)C(=S)N

Isomeric SMILES

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

InChI

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