N-[(2-methoxyphenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(3-isopropoxyphenyl)-N-[(2-methoxyphenyl)carbamothioyl]quinoline-4-carboxamide CAS Name: N-[(2-methoxyanilino)-sulfanylidenemethyl]-2-(3-propan-2-yloxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)carbamothioyl]-2-(3-propan-2-yloxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(3-isopropoxyphenyl)-N-[(2-methoxyphenyl)thiocarbamoyl]cinchoninamide Formula: C27H25N3O3S MolecularWeight: 471.5707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=CC=CC=C4OC

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=CC=CC=C4OC

InChI

InChI=1S/C27H25N3O3S/c1-17(2)33-19-10-8-9-18(15-19)24-16-21(20-11-4-5-12-22(20)28-24)26(31)30-27(34)29-23-13-6-7-14-25(23)32-3/h4-17H,1-3H3,(H2,29,30,31,34)