N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)quinoline-4-carboxamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)quinoline-4-carboxamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)quinoline-4-carboxamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)quinoline-4-carboxamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-(4-chlorophenyl)cinchoninamide Formula: C28H25ClN4OS MolecularWeight: 501.0423

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=C(C=C7)Cl

InChI

InChI=1S/C28H25ClN4OS/c29-20-7-5-19(6-8-20)24-12-22(21-3-1-2-4-23(21)30-24)25(34)31-27-33-32-26(35-27)28-13-16-9-17(14-28)11-18(10-16)15-28/h1-8,12,16-18H,9-11,13-15H2,(H,31,33,34)