N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(2-pyridylmethyl)quinoline-4-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(2-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenyl-N-(2-pyridylmethyl)cinchoninamide Formula: C31H24N4O2S MolecularWeight: 516.61286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C31H24N4O2S/c1-2-37-23-15-16-27-29(18-23)38-31(34-27)35(20-22-12-8-9-17-32-22)30(36)25-19-28(21-10-4-3-5-11-21)33-26-14-7-6-13-24(25)26/h3-19H,2,20H2,1H3