5-[4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3-methoxy-phenyl]-1,2-oxazole

Systemtic Name: 5-[4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3-methoxy-phenyl]-1,2-oxazole Openeye Name: 5-[4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3-methoxy-phenyl]isoxazole CAS Name: 5-[4-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-3-methoxyphenyl]isoxazole IUPAC Name: 5-[4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-3-methoxyphenyl]-1,2-oxazole Traditional Name: 5-[4-[4-(3-chlorophenyl)piperazino]sulfonyl-3-methoxy-phenyl]isoxazole Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC=NO2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC=NO2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN3O4S/c1-27-19-13-15(18-7-8-22-28-18)5-6-20(19)29(25,26)24-11-9-23(10-12-24)17-4-2-3-16(21)14-17/h2-8,13-14H,9-12H2,1H3