N-(2-propan-2-ylphenyl)-5-(2-pyridin-3-ylquinolin-4-yl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2-propan-2-ylphenyl)-5-(2-pyridin-3-ylquinolin-4-yl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-isopropylphenyl)-5-[2-(3-pyridyl)-4-quinolyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-propan-2-ylphenyl)-5-[2-(3-pyridinyl)-4-quinolinyl]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2-propan-2-ylphenyl)-5-(2-pyridin-3-ylquinolin-4-yl)-1,3,4-thiadiazol-2-amine Traditional Name: o-cumenyl-[5-[2-(3-pyridyl)-4-quinolyl]-1,3,4-thiadiazol-2-yl]amine Formula: C25H21N5S MolecularWeight: 423.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC2=NN=C(S2)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

CC(C)C1=CC=CC=C1NC2=NN=C(S2)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C25H21N5S/c1-16(2)18-9-3-5-11-21(18)28-25-30-29-24(31-25)20-14-23(17-8-7-13-26-15-17)27-22-12-6-4-10-19(20)22/h3-16H,1-2H3,(H,28,30)