2-phenyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-phenyl-N-[4-(4-propoxyphenyl)thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-phenyl-N-[4-(4-propoxyphenyl)-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-phenyl-N-[4-(4-propoxyphenyl)thiazol-2-yl]cinchoninamide Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H23N3O2S/c1-2-16-33-21-14-12-20(13-15-21)26-18-34-28(30-26)31-27(32)23-17-25(19-8-4-3-5-9-19)29-24-11-7-6-10-22(23)24/h3-15,17-18H,2,16H2,1H3,(H,30,31,32)