N-cyclopropyl-2-[2-oxidanylidene-2-(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-oxidanylidene-2-(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-oxo-2-(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-oxo-2-(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-oxo-2-(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-2-(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)ethyl]thio]cinchoninamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5)NC(=O)C1

InChI

InChI=1S/C25H23N3O3S/c29-22(16-8-11-20-15(12-16)4-3-7-23(30)27-20)14-32-24-13-19(25(31)26-17-9-10-17)18-5-1-2-6-21(18)28-24/h1-2,5-6,8,11-13,17H,3-4,7,9-10,14H2,(H,26,31)(H,27,30)