N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-2-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-2-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-2-oxo-1H-quinoline-6-sulfonamide CAS Name: N-[2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl]-2-oxo-1H-quinoline-6-sulfonamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-2-oxo-1H-quinoline-6-sulfonamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]ethyl]-2-keto-1H-quinoline-6-sulfonamide Formula: C21H23FN4O3S MolecularWeight: 430.495723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCN1CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3)C4=CC=CC=C4F

InChI

InChI=1S/C21H23FN4O3S/c22-18-3-1-2-4-20(18)26-13-11-25(12-14-26)10-9-23-30(28,29)17-6-7-19-16(15-17)5-8-21(27)24-19/h1-8,15,23H,9-14H2,(H,24,27)