5-phenyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one

Systemtic Name: 5-phenyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one Openeye Name: 5-phenyl-3-[4-(1-piperidyl)but-2-ynyl]-1,3,4-thiadiazol-2-one CAS Name: 5-phenyl-3-[4-(1-piperidinyl)but-2-ynyl]-1,3,4-thiadiazol-2-one IUPAC Name: 5-phenyl-3-(4-piperidin-1-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one Traditional Name: 5-phenyl-3-(4-piperidinobut-2-ynyl)-1,3,4-thiadiazol-2-one Formula: C17H19N3OS MolecularWeight: 313.41726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CCN2C(=O)SC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CC#CCN2C(=O)SC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3OS/c21-17-20(14-8-7-13-19-11-5-2-6-12-19)18-16(22-17)15-9-3-1-4-10-15/h1,3-4,9-10H,2,5-6,11-14H2