N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)sulfonylphenyl]-7-fluoro-2-methyl-cinchoninamide Formula: C23H25FN4O3S MolecularWeight: 456.533003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=CC(=C4)F)C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=C3C=CC(=C4)F)C

InChI

InChI=1S/C23H25FN4O3S/c1-3-27-10-12-28(13-11-27)32(30,31)19-7-5-18(6-8-19)26-23(29)21-14-16(2)25-22-15-17(24)4-9-20(21)22/h4-9,14-15H,3,10-13H2,1-2H3,(H,26,29)