2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)quinoline-4-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-thiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-2-thiazolyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-(5-methyl-4-phenyl-thiazol-2-yl)cinchoninamide Formula: C27H19N3O3S MolecularWeight: 465.52306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

InChI

InChI=1S/C27H19N3O3S/c1-16-25(17-7-3-2-4-8-17)29-27(34-16)30-26(31)20-14-22(28-21-10-6-5-9-19(20)21)18-11-12-23-24(13-18)33-15-32-23/h2-14H,15H2,1H3,(H,29,30,31)