1-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzo[f]chromen-3-one

Systemtic Name: 1-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzo[f]chromen-3-one Openeye Name: 1-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]benzo[f]chromen-3-one CAS Name: 1-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-3-benzo[f][1]benzopyranone IUPAC Name: 1-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzo[f]chromen-3-one Traditional Name: 1-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]benzo[f]chromen-3-one Formula: C23H20N2O4S2 MolecularWeight: 452.5459

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C23H20N2O4S2/c26-22-13-17(23-19-6-2-1-5-16(19)7-9-20(23)29-22)15-30-21-10-8-18(14-24-21)31(27,28)25-11-3-4-12-25/h1-2,5-10,13-14H,3-4,11-12,15H2