2-[1-[2-[(4-carbamothioylphenyl)carbonylamino]ethanoyl]piperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[2-[(4-carbamothioylphenyl)carbonylamino]ethanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[2-[(4-carbamothioylbenzoyl)amino]acetyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[2-[[(4-carbamothioylphenyl)-oxomethyl]amino]-1-oxoethyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[2-[(4-carbamothioylbenzoyl)amino]acetyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[2-[(4-thiocarbamoylbenzoyl)amino]acetyl]-4-piperidyl]oxy]acetic acid Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)O)C(=O)CNC(=O)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CN(CCC1OCC(=O)O)C(=O)CNC(=O)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C17H21N3O5S/c18-16(26)11-1-3-12(4-2-11)17(24)19-9-14(21)20-7-5-13(6-8-20)25-10-15(22)23/h1-4,13H,5-10H2,(H2,18,26)(H,19,24)(H,22,23)