6-cyclopentylsulfonyl-4-[(3-fluorophenyl)amino]quinoline-3-carboxamide

Systemtic Name: 6-cyclopentylsulfonyl-4-[(3-fluorophenyl)amino]quinoline-3-carboxamide Openeye Name: 6-cyclopentylsulfonyl-4-(3-fluoroanilino)quinoline-3-carboxamide CAS Name: 6-cyclopentylsulfonyl-4-(3-fluoroanilino)-3-quinolinecarboxamide IUPAC Name: 6-cyclopentylsulfonyl-4-(3-fluoroanilino)quinoline-3-carboxamide Traditional Name: 6-cyclopentylsulfonyl-4-(3-fluoroanilino)quinoline-3-carboxamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=CC(=CC=C4)F

InChI

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