3,4-dimethyl-5-[4-methyl-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole

Systemtic Name: 3,4-dimethyl-5-[4-methyl-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole Openeye Name: 3,4-dimethyl-5-[4-methyl-3-(4-phenylpiperazin-1-yl)sulfonyl-phenyl]isoxazole CAS Name: 3,4-dimethyl-5-[4-methyl-3-[(4-phenyl-1-piperazinyl)sulfonyl]phenyl]isoxazole IUPAC Name: 3,4-dimethyl-5-[4-methyl-3-(4-phenylpiperazin-1-yl)sulfonylphenyl]-1,2-oxazole Traditional Name: 3,4-dimethyl-5-[4-methyl-3-(4-phenylpiperazino)sulfonyl-phenyl]isoxazole Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NO2)C)C)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3S/c1-16-9-10-19(22-17(2)18(3)23-28-22)15-21(16)29(26,27)25-13-11-24(12-14-25)20-7-5-4-6-8-20/h4-10,15H,11-14H2,1-3H3