3-[3-(2,6-dimethyl-4-oxidanyl-oxan-4-yl)phenyl]-4-phenyl-2-(2-prop-1-ynyl-1,3-oxazol-5-yl)benzenesulfonamide

Systemtic Name: 3-[3-(2,6-dimethyl-4-oxidanyl-oxan-4-yl)phenyl]-4-phenyl-2-(2-prop-1-ynyl-1,3-oxazol-5-yl)benzenesulfonamide Openeye Name: 3-[3-(4-hydroxy-2,6-dimethyl-tetrahydropyran-4-yl)phenyl]-4-phenyl-2-(2-prop-1-ynyloxazol-5-yl)benzenesulfonamide CAS Name: 3-[3-(4-hydroxy-2,6-dimethyl-4-oxanyl)phenyl]-4-phenyl-2-(2-prop-1-ynyl-5-oxazolyl)benzenesulfonamide IUPAC Name: 3-[3-(4-hydroxy-2,6-dimethyloxan-4-yl)phenyl]-4-phenyl-2-(2-prop-1-ynyl-1,3-oxazol-5-yl)benzenesulfonamide Traditional Name: 3-[3-(4-hydroxy-2,6-dimethyl-tetrahydropyran-4-yl)phenyl]-4-phenyl-2-(2-prop-1-ynyloxazol-5-yl)benzenesulfonamide Formula: C31H30N2O5S MolecularWeight: 542.6453

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=NC=C(O1)C2=C(C=CC(=C2C3=CC(=CC=C3)C4(CC(OC(C4)C)C)O)C5=CC=CC=C5)S(=O)(=O)N

Isomeric SMILES

CC#CC1=NC=C(O1)C2=C(C=CC(=C2C3=CC(=CC=C3)C4(CC(OC(C4)C)C)O)C5=CC=CC=C5)S(=O)(=O)N

InChI

InChI=1S/C31H30N2O5S/c1-4-9-28-33-19-26(38-28)30-27(39(32,35)36)15-14-25(22-10-6-5-7-11-22)29(30)23-12-8-13-24(16-23)31(34)17-20(2)37-21(3)18-31/h5-8,10-16,19-21,34H,17-18H2,1-3H3,(H2,32,35,36)