N-cyclopropyl-2-[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[1-(1-naphthyl)ethylamino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[1-(1-naphthalenyl)ethylamino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(1-naphthalen-1-ylethylamino)-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-2-[1-(1-naphthyl)ethylamino]ethyl]thio]cinchoninamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C27H25N3O2S/c1-17(20-11-6-8-18-7-2-3-9-21(18)20)28-25(31)16-33-26-15-23(27(32)29-19-13-14-19)22-10-4-5-12-24(22)30-26/h2-12,15,17,19H,13-14,16H2,1H3,(H,28,31)(H,29,32)