2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)thiazol-2-yl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)-2-thiazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[4-(4-nitrophenyl)thiazol-2-yl]cinchoninamide Formula: C27H20N4O5S MolecularWeight: 512.5365

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=NC(=CS4)C5=CC=C(C=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C27H20N4O5S/c1-35-24-12-9-17(13-25(24)36-2)22-14-20(19-5-3-4-6-21(19)28-22)26(32)30-27-29-23(15-37-27)16-7-10-18(11-8-16)31(33)34/h3-15H,1-2H3,(H,29,30,32)