3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-2-oxidanyl-chromen-4-one Openeye Name: 3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-2-hydroxy-chromen-4-one CAS Name: 3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropylmethyl]-2-hydroxy-1-benzopyran-4-one IUPAC Name: 3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropylmethyl]-2-hydroxychromen-4-one Traditional Name: 3-[[3-(1H-benzimidazol-2-ylsulfonylmethyl)phenyl]-cyclopropyl-methyl]-2-hydroxy-chromone Formula: C27H22N2O5S MolecularWeight: 486.53898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC(=C2)CS(=O)(=O)C3=NC4=CC=CC=C4N3)C5=C(OC6=CC=CC=C6C5=O)O

Isomeric SMILES

C1CC1C(C2=CC=CC(=C2)CS(=O)(=O)C3=NC4=CC=CC=C4N3)C5=C(OC6=CC=CC=C6C5=O)O

InChI

InChI=1S/C27H22N2O5S/c30-25-19-8-1-4-11-22(19)34-26(31)24(25)23(17-12-13-17)18-7-5-6-16(14-18)15-35(32,33)27-28-20-9-2-3-10-21(20)29-27/h1-11,14,17,23,31H,12-13,15H2,(H,28,29)