3-chloranyl-N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-fluoranyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-fluoranyl-benzenesulfonamide Openeye Name: 3-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-fluoro-benzenesulfonamide CAS Name: 3-chloro-N-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-fluorobenzenesulfonamide IUPAC Name: 3-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-fluorobenzenesulfonamide Traditional Name: 3-chloro-N-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-fluoro-benzenesulfonamide Formula: C19H18ClFN2O3S MolecularWeight: 408.874223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H18ClFN2O3S/c20-17-10-16(5-6-18(17)21)27(25,26)22-15-4-3-12-7-8-23(11-14(12)9-15)19(24)13-1-2-13/h3-6,9-10,13,22H,1-2,7-8,11H2