4-[5-(4-piperidin-1-ylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid

Systemtic Name: 4-[5-(4-piperidin-1-ylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid Openeye Name: 4-[5-[4-(1-piperidyl)phenyl]-1,3,4-thiadiazol-2-yl]benzoic acid CAS Name: 4-[5-[4-(1-piperidinyl)phenyl]-1,3,4-thiadiazol-2-yl]benzoic acid IUPAC Name: 4-[5-(4-piperidin-1-ylphenyl)-1,3,4-thiadiazol-2-yl]benzoic acid Traditional Name: 4-[5-(4-piperidinophenyl)-1,3,4-thiadiazol-2-yl]benzoic acid Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(S3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(S3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H19N3O2S/c24-20(25)16-6-4-14(5-7-16)18-21-22-19(26-18)15-8-10-17(11-9-15)23-12-2-1-3-13-23/h4-11H,1-3,12-13H2,(H,24,25)