N-[2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2-furoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CO5)C=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CO5)C=C3

InChI

InChI=1S/C25H25N3O5S/c29-24(19-6-9-22(10-7-19)34(31,32)28-12-1-2-13-28)26-21-8-5-18-11-14-27(17-20(18)16-21)25(30)23-4-3-15-33-23/h3-10,15-16H,1-2,11-14,17H2,(H,26,29)