5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-6-oxidanyl-2-phenethyl-2-propyl-3H-pyran-4-one

Systemtic Name: 5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-6-oxidanyl-2-phenethyl-2-propyl-3H-pyran-4-one Openeye Name: 5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one CAS Name: 5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropylmethyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one IUPAC Name: 5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropylmethyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one Traditional Name: 5-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one Formula: C34H36N2O5S MolecularWeight: 584.72504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C(O1)O)C(C2CC2)C3=CC=CC(=C3)CS(=O)(=O)C4=NC5=CC=CC=C5N4)CCC6=CC=CC=C6

Isomeric SMILES

CCCC1(CC(=O)C(=C(O1)O)C(C2CC2)C3=CC=CC(=C3)CS(=O)(=O)C4=NC5=CC=CC=C5N4)CCC6=CC=CC=C6

InChI

InChI=1S/C34H36N2O5S/c1-2-18-34(19-17-23-9-4-3-5-10-23)21-29(37)31(32(38)41-34)30(25-15-16-25)26-12-8-11-24(20-26)22-42(39,40)33-35-27-13-6-7-14-28(27)36-33/h3-14,20,25,30,38H,2,15-19,21-22H2,1H3,(H,35,36)