1-(2,3-dihydro-1-benzofuran-4-ylsulfonyl)-3-(4-pyrrolidin-1-ylcyclohexen-1-yl)pyrrolo[3,2-b]pyridine

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-4-ylsulfonyl)-3-(4-pyrrolidin-1-ylcyclohexen-1-yl)pyrrolo[3,2-b]pyridine Openeye Name: 1-(2,3-dihydrobenzofuran-4-ylsulfonyl)-3-(4-pyrrolidin-1-ylcyclohexen-1-yl)pyrrolo[3,2-b]pyridine CAS Name: 1-(2,3-dihydrobenzofuran-4-ylsulfonyl)-3-[4-(1-pyrrolidinyl)-1-cyclohexenyl]pyrrolo[3,2-b]pyridine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-4-ylsulfonyl)-3-(4-pyrrolidin-1-ylcyclohexen-1-yl)pyrrolo[3,2-b]pyridine Traditional Name: 1-coumaran-4-ylsulfonyl-3-(4-pyrrolidinocyclohexen-1-yl)pyrrolo[3,2-b]pyridine Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCC(=CC2)C3=CN(C4=C3N=CC=C4)S(=O)(=O)C5=CC=CC6=C5CCO6

Isomeric SMILES

C1CCN(C1)C2CCC(=CC2)C3=CN(C4=C3N=CC=C4)S(=O)(=O)C5=CC=CC6=C5CCO6

InChI

InChI=1S/C25H27N3O3S/c29-32(30,24-7-3-6-23-20(24)12-16-31-23)28-17-21(25-22(28)5-4-13-26-25)18-8-10-19(11-9-18)27-14-1-2-15-27/h3-8,13,17,19H,1-2,9-12,14-16H2