3-[4-[(5-piperidin-4-yl-1,3,4-thiadiazol-2-yl)carbonylamino]piperidin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(5-piperidin-4-yl-1,3,4-thiadiazol-2-yl)carbonylamino]piperidin-1-yl]propanoic acid Openeye Name: 3-[4-[[5-(4-piperidyl)-1,3,4-thiadiazole-2-carbonyl]amino]-1-piperidyl]propanoic acid CAS Name: 3-[4-[[oxo-[5-(4-piperidinyl)-1,3,4-thiadiazol-2-yl]methyl]amino]-1-piperidinyl]propanoic acid IUPAC Name: 3-[4-[(5-piperidin-4-yl-1,3,4-thiadiazole-2-carbonyl)amino]piperidin-1-yl]propanoic acid Traditional Name: 3-[4-[[5-(4-piperidyl)-1,3,4-thiadiazole-2-carbonyl]amino]piperidino]propionic acid Formula: C16H25N5O3S MolecularWeight: 367.4664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NN=C(S2)C(=O)NC3CCN(CC3)CCC(=O)O

Isomeric SMILES

C1CNCCC1C2=NN=C(S2)C(=O)NC3CCN(CC3)CCC(=O)O

InChI

InChI=1S/C16H25N5O3S/c22-13(23)5-10-21-8-3-12(4-9-21)18-14(24)16-20-19-15(25-16)11-1-6-17-7-2-11/h11-12,17H,1-10H2,(H,18,24)(H,22,23)