2-(furan-2-ylcarbonyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-(4-pyrrolidinosulfonylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide 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)NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

InChI

InChI=1S/C25H25N3O5S/c29-24(26-20-9-11-21(12-10-20)34(31,32)27-13-3-4-14-27)22-16-18-6-1-2-7-19(18)17-28(22)25(30)23-8-5-15-33-23/h1-2,5-12,15,22H,3-4,13-14,16-17H2,(H,26,29)