N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-7-fluoro-2-methyl-cinchoninamide Formula: C21H18FN3OS MolecularWeight: 379.450523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18FN3OS/c1-13-11-16(15-9-8-14(22)12-18(15)24-13)21(26)23-10-4-7-20-25-17-5-2-3-6-19(17)27-20/h2-3,5-6,8-9,11-12H,4,7,10H2,1H3,(H,23,26)