N-cyclopropyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[(4-keto-1H-quinazolin-2-yl)methylthio]cinchoninamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C22H18N4O2S/c27-21-15-6-2-4-8-18(15)24-19(26-21)12-29-20-11-16(22(28)23-13-9-10-13)14-5-1-3-7-17(14)25-20/h1-8,11,13H,9-10,12H2,(H,23,28)(H,24,26,27)