4-(3,4-dimethoxyphenyl)-4-(3-methylsulfonylphenyl)-2-(phenylmethyl)-5H-1,3-oxazole

Systemtic Name: 4-(3,4-dimethoxyphenyl)-4-(3-methylsulfonylphenyl)-2-(phenylmethyl)-5H-1,3-oxazole Openeye Name: 2-benzyl-4-(3,4-dimethoxyphenyl)-4-(3-methylsulfonylphenyl)-5H-oxazole CAS Name: 4-(3,4-dimethoxyphenyl)-4-(3-methylsulfonylphenyl)-2-(phenylmethyl)-5H-oxazole IUPAC Name: 2-benzyl-4-(3,4-dimethoxyphenyl)-4-(3-methylsulfonylphenyl)-5H-1,3-oxazole Traditional Name: 2-benzyl-4-(3,4-dimethoxyphenyl)-4-(3-mesylphenyl)-2-oxazoline Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(COC(=N2)CC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(COC(=N2)CC3=CC=CC=C3)C4=CC(=CC=C4)S(=O)(=O)C)OC

InChI

InChI=1S/C25H25NO5S/c1-29-22-13-12-20(16-23(22)30-2)25(19-10-7-11-21(15-19)32(3,27)28)17-31-24(26-25)14-18-8-5-4-6-9-18/h4-13,15-16H,14,17H2,1-3H3