2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-5-piperidin-1-ylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Openeye Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-5-(1-piperidylsulfonyl)-1,3-benzoxazole CAS Name: 2-(2-imidazo[1,2-a]pyridinylmethylthio)-5-(1-piperidinylsulfonyl)-1,3-benzoxazole IUPAC Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Traditional Name: 2-(imidazo[1,2-a]pyridin-2-ylmethylthio)-5-piperidinosulfonyl-1,3-benzoxazole Formula: C20H20N4O3S2 MolecularWeight: 428.5278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=CN5C=CC=CC5=N4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=CN5C=CC=CC5=N4

InChI

InChI=1S/C20H20N4O3S2/c25-29(26,24-10-3-1-4-11-24)16-7-8-18-17(12-16)22-20(27-18)28-14-15-13-23-9-5-2-6-19(23)21-15/h2,5-9,12-13H,1,3-4,10-11,14H2