2-(3-chlorophenyl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(3-chlorophenyl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)quinoline-4-carboxamide CAS Name: 2-[(3-chlorophenyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(3-chlorophenyl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-[(3-chlorophenyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)cinchoninamide Formula: C25H19ClN2O3S MolecularWeight: 462.94796

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=CC(=NC4=CC=CC=C43)SC5=CC(=CC=C5)Cl

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)C3=CC(=NC4=CC=CC=C43)SC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H19ClN2O3S/c26-16-6-5-7-18(12-16)32-24-13-20(19-8-1-2-9-21(19)28-24)25(29)27-14-17-15-30-22-10-3-4-11-23(22)31-17/h1-13,17H,14-15H2,(H,27,29)