2-(3-nitro-4-quinolin-8-ylsulfanyl-phenyl)-2,3-dihydro-1H-quinazolin-4-one

Systemtic Name: 2-(3-nitro-4-quinolin-8-ylsulfanyl-phenyl)-2,3-dihydro-1H-quinazolin-4-one Openeye Name: 2-[3-nitro-4-(8-quinolylsulfanyl)phenyl]-2,3-dihydro-1H-quinazolin-4-one CAS Name: 2-[3-nitro-4-(8-quinolinylthio)phenyl]-2,3-dihydro-1H-quinazolin-4-one IUPAC Name: 2-(3-nitro-4-quinolin-8-ylsulfanylphenyl)-2,3-dihydro-1H-quinazolin-4-one Traditional Name: 2-[3-nitro-4-(8-quinolylthio)phenyl]-2,3-dihydro-1H-quinazolin-4-one Formula: C23H16N4O3S MolecularWeight: 428.46314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC(=C(C=C3)SC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC(=C(C=C3)SC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O3S/c28-23-16-7-1-2-8-17(16)25-22(26-23)15-10-11-19(18(13-15)27(29)30)31-20-9-3-5-14-6-4-12-24-21(14)20/h1-13,22,25H,(H,26,28)