7-fluoranyl-N-[3-(3-methoxypropylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-quinoline-4-carboxamide

Systemtic Name: 7-fluoranyl-N-[3-(3-methoxypropylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-quinoline-4-carboxamide Openeye Name: 7-fluoro-N-[3-(3-methoxypropylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-quinoline-4-carboxamide CAS Name: 7-fluoro-N-[3-[(3-methoxypropylamino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-4-quinolinecarboxamide IUPAC Name: 7-fluoro-N-[3-(3-methoxypropylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylquinoline-4-carboxamide Traditional Name: 7-fluoro-N-[3-(3-methoxypropylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-cinchoninamide Formula: C24H26FN3O3S MolecularWeight: 455.544943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCCCOC

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCCCOC

InChI

InChI=1S/C24H26FN3O3S/c1-14-12-18(16-9-8-15(25)13-19(16)27-14)22(29)28-24-21(23(30)26-10-5-11-31-2)17-6-3-4-7-20(17)32-24/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,26,30)(H,28,29)