2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Openeye Name: 2-[[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(1-piperidylsulfonyl)-1,3-benzoxazole CAS Name: 2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-5-(1-piperidinylsulfonyl)-1,3-benzoxazole IUPAC Name: 2-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Traditional Name: 2-[[3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methylthio]-5-piperidinosulfonyl-1,3-benzoxazole Formula: C22H22N4O4S2 MolecularWeight: 470.56448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=C(O3)C=CC(=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NC4=C(O3)C=CC(=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C22H22N4O4S2/c1-15-7-3-4-8-17(15)21-24-20(30-25-21)14-31-22-23-18-13-16(9-10-19(18)29-22)32(27,28)26-11-5-2-6-12-26/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3