N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[2-(3-nitrophenoxy)ethylthio]cinchoninamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCCOC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCCOC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4S/c25-21(22-14-8-9-14)18-13-20(23-19-7-2-1-6-17(18)19)29-11-10-28-16-5-3-4-15(12-16)24(26)27/h1-7,12-14H,8-11H2,(H,22,25)