N-cyclopropyl-2-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-2-(o-phenetidino)-1-phenyl-ethyl]thio]cinchoninamide Formula: C29H27N3O3S MolecularWeight: 497.60798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C29H27N3O3S/c1-2-35-25-15-9-8-14-24(25)32-29(34)27(19-10-4-3-5-11-19)36-26-18-22(28(33)30-20-16-17-20)21-12-6-7-13-23(21)31-26/h3-15,18,20,27H,2,16-17H2,1H3,(H,30,33)(H,32,34)