2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Openeye Name: 2-[(5-phenyloxazol-2-yl)methylsulfanyl]-5-(1-piperidylsulfonyl)-1,3-benzoxazole CAS Name: 2-[(5-phenyl-2-oxazolyl)methylthio]-5-(1-piperidinylsulfonyl)-1,3-benzoxazole IUPAC Name: 2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Traditional Name: 2-[(5-phenyloxazol-2-yl)methylthio]-5-piperidinosulfonyl-1,3-benzoxazole Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC=C(O4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C22H21N3O4S2/c26-31(27,25-11-5-2-6-12-25)17-9-10-19-18(13-17)24-22(29-19)30-15-21-23-14-20(28-21)16-7-3-1-4-8-16/h1,3-4,7-10,13-14H,2,5-6,11-12,15H2