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

Systemtic Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-(5-neopentyl-1,3,4-thiadiazol-2-yl)-2-phenyl-cinchoninamide Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4OS/c1-23(2,3)14-20-26-27-22(29-20)25-21(28)17-13-19(15-9-5-4-6-10-15)24-18-12-8-7-11-16(17)18/h4-13H,14H2,1-3H3,(H,25,27,28)