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

Systemtic Name: 5-[3-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-ethyl-phenyl]-3-methyl-1,2-oxazole Openeye Name: 5-[3-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-ethyl-phenyl]-3-methyl-isoxazole CAS Name: 5-[3-[[3-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]sulfonyl]-4-ethylphenyl]-3-methylisoxazole IUPAC Name: 5-[3-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4-ethylphenyl]-3-methyl-1,2-oxazole Traditional Name: 5-[3-[3-(2,5-dimethoxyphenyl)pyrrolidino]sulfonyl-4-ethyl-phenyl]-3-methyl-isoxazole Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCC(C3)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCC(C3)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C24H28N2O5S/c1-5-17-6-7-18(23-12-16(2)25-31-23)13-24(17)32(27,28)26-11-10-19(15-26)21-14-20(29-3)8-9-22(21)30-4/h6-9,12-14,19H,5,10-11,15H2,1-4H3