2-(4-iodophenyl)-4-(4-methylphenyl)sulfonyl-5-piperidin-1-yl-1,3-oxazole

Systemtic Name: 2-(4-iodophenyl)-4-(4-methylphenyl)sulfonyl-5-piperidin-1-yl-1,3-oxazole Openeye Name: 2-(4-iodophenyl)-5-(1-piperidyl)-4-(p-tolylsulfonyl)oxazole CAS Name: 2-(4-iodophenyl)-4-(4-methylphenyl)sulfonyl-5-(1-piperidinyl)oxazole IUPAC Name: 2-(4-iodophenyl)-4-(4-methylphenyl)sulfonyl-5-piperidin-1-yl-1,3-oxazole Traditional Name: 2-(4-iodophenyl)-5-piperidino-4-tosyl-oxazole Formula: C21H21IN2O3S MolecularWeight: 508.37251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=C(C=C3)I)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=C(C=C3)I)N4CCCCC4

InChI

InChI=1S/C21H21IN2O3S/c1-15-5-11-18(12-6-15)28(25,26)20-21(24-13-3-2-4-14-24)27-19(23-20)16-7-9-17(22)10-8-16/h5-12H,2-4,13-14H2,1H3