N-(4-fluorophenyl)-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(4-fluorophenyl)-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)isoquinoline-5-sulfonamide Openeye Name: N-(4-fluorophenyl)-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)isoquinoline-5-sulfonamide CAS Name: N-(4-fluorophenyl)-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-(4-fluorophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)isoquinoline-5-sulfonamide Traditional Name: N-(4-fluorophenyl)-N-(2-keto-2-pyrrolidino-ethyl)isoquinoline-5-sulfonamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CCN(C1)C(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H20FN3O3S/c22-17-6-8-18(9-7-17)25(15-21(26)24-12-1-2-13-24)29(27,28)20-5-3-4-16-14-23-11-10-19(16)20/h3-11,14H,1-2,12-13,15H2