4-methoxy-N-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzamide

Systemtic Name: 4-methoxy-N-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzamide Openeye Name: 4-methoxy-N-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzamide CAS Name: 4-methoxy-N-[2-[(3-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]benzamide IUPAC Name: 4-methoxy-N-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzamide Traditional Name: N-[4-keto-2-[(3-nitrobenzyl)thio]quinazolin-3-yl]-4-methoxy-benzamide Formula: C23H18N4O5S MolecularWeight: 462.47782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5S/c1-32-18-11-9-16(10-12-18)21(28)25-26-22(29)19-7-2-3-8-20(19)24-23(26)33-14-15-5-4-6-17(13-15)27(30)31/h2-13H,14H2,1H3,(H,25,28)