7-[1-[(5-thiophen-2-ylpyridin-3-yl)methyl]piperidin-3-yl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 7-[1-[(5-thiophen-2-ylpyridin-3-yl)methyl]piperidin-3-yl]-3H-1,3-benzoxazol-2-one Openeye Name: 7-[1-[[5-(2-thienyl)-3-pyridyl]methyl]-3-piperidyl]-3H-1,3-benzoxazol-2-one CAS Name: 7-[1-[(5-thiophen-2-yl-3-pyridinyl)methyl]-3-piperidinyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 7-[1-[(5-thiophen-2-ylpyridin-3-yl)methyl]piperidin-3-yl]-3H-1,3-benzoxazol-2-one Traditional Name: 7-[1-[[5-(2-thienyl)-3-pyridyl]methyl]-3-piperidyl]-3H-1,3-benzoxazol-2-one Formula: C22H21N3O2S MolecularWeight: 391.48604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN=CC(=C2)C3=CC=CS3)C4=C5C(=CC=C4)NC(=O)O5

Isomeric SMILES

C1CC(CN(C1)CC2=CN=CC(=C2)C3=CC=CS3)C4=C5C(=CC=C4)NC(=O)O5

InChI

InChI=1S/C22H21N3O2S/c26-22-24-19-6-1-5-18(21(19)27-22)16-4-2-8-25(14-16)13-15-10-17(12-23-11-15)20-7-3-9-28-20/h1,3,5-7,9-12,16H,2,4,8,13-14H2,(H,24,26)