N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]-7-fluoro-2-methyl-cinchoninamide Formula: C25H23FN4O2S MolecularWeight: 462.539123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)CCCNC(=O)C

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)F)C(=C1)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)CCCNC(=O)C

InChI

InChI=1S/C25H23FN4O2S/c1-15-12-21(20-10-9-19(26)13-22(20)28-15)24(32)30-25-29-23(14-33-25)18-7-5-17(6-8-18)4-3-11-27-16(2)31/h5-10,12-14H,3-4,11H2,1-2H3,(H,27,31)(H,29,30,32)