2-[(3-nitrophenyl)methylsulfanyl]-3-(3-oxidanylidene-3-piperidin-1-yl-propyl)quinazolin-4-one

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-3-(3-oxidanylidene-3-piperidin-1-yl-propyl)quinazolin-4-one Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-3-[3-oxo-3-(1-piperidyl)propyl]quinazolin-4-one CAS Name: 2-[(3-nitrophenyl)methylthio]-3-[3-oxo-3-(1-piperidinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-3-(3-oxo-3-piperidin-1-ylpropyl)quinazolin-4-one Traditional Name: 3-(3-keto-3-piperidino-propyl)-2-[(3-nitrobenzyl)thio]quinazolin-4-one Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O4S/c28-21(25-12-4-1-5-13-25)11-14-26-22(29)19-9-2-3-10-20(19)24-23(26)32-16-17-7-6-8-18(15-17)27(30)31/h2-3,6-10,15H,1,4-5,11-14,16H2