N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-7-fluoro-2-methyl-cinchoninamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C

InChI

InChI=1S/C21H22FN3O3S/c1-13-4-5-14(2)20(10-13)29(27,28)24-9-8-23-21(26)18-11-15(3)25-19-12-16(22)6-7-17(18)19/h4-7,10-12,24H,8-9H2,1-3H3,(H,23,26)