2-(piperidin-1-ylcarbothioylamino)benzoic acid

Systemtic Name: 2-(piperidin-1-ylcarbothioylamino)benzoic acid Openeye Name: 2-(piperidine-1-carbothioylamino)benzoic acid CAS Name: 2-[[1-piperidinyl(sulfanylidene)methyl]amino]benzoic acid IUPAC Name: 2-(piperidine-1-carbothioylamino)benzoic acid Traditional Name: 2-(piperidine-1-carbothioylamino)benzoic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CCN(CC1)C(=S)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H16N2O2S/c16-12(17)10-6-2-3-7-11(10)14-13(18)15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-9H2,(H,14,18)(H,16,17)