5-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-4-ethyl-phenyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-4-ethyl-phenyl]-3-methyl-1,2-oxazole Openeye Name: 5-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-4-ethyl-phenyl]-3-methyl-isoxazole CAS Name: 5-[3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]-4-ethylphenyl]-3-methylisoxazole IUPAC Name: 5-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-4-ethylphenyl]-3-methyl-1,2-oxazole Traditional Name: 5-[3-[4-(2,5-dimethylphenyl)piperazino]sulfonyl-4-ethyl-phenyl]-3-methyl-isoxazole Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCN(CC3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C24H29N3O3S/c1-5-20-8-9-21(23-15-19(4)25-30-23)16-24(20)31(28,29)27-12-10-26(11-13-27)22-14-17(2)6-7-18(22)3/h6-9,14-16H,5,10-13H2,1-4H3