(3S)-1-(4-carbamothioylphenyl)carbonylpiperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-carbamothioylphenyl)carbonylpiperidine-3-carboxamide Openeye Name: (3S)-1-(4-carbamothioylbenzoyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-carbamothioylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-carbamothioylbenzoyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-thiocarbamoylbenzoyl)nipecotamide Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)C(=S)N)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=C(C=C2)C(=S)N)C(=O)N

InChI

InChI=1S/C14H17N3O2S/c15-12(18)11-2-1-7-17(8-11)14(19)10-5-3-9(4-6-10)13(16)20/h3-6,11H,1-2,7-8H2,(H2,15,18)(H2,16,20)/t11-/m0/s1