3-nitro-4-[[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: 3-nitro-4-[[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanylmethyl]benzamide Openeye Name: 3-nitro-4-[[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylmethyl]benzamide CAS Name: 3-nitro-4-[[[4-oxo-3-(1-phenylethyl)-2-quinazolinyl]thio]methyl]benzamide IUPAC Name: 3-nitro-4-[[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylmethyl]benzamide Traditional Name: 4-[[[4-keto-3-(1-phenylethyl)quinazolin-2-yl]thio]methyl]-3-nitro-benzamide Formula: C24H20N4O4S MolecularWeight: 460.505

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O4S/c1-15(16-7-3-2-4-8-16)27-23(30)19-9-5-6-10-20(19)26-24(27)33-14-18-12-11-17(22(25)29)13-21(18)28(31)32/h2-13,15H,14H2,1H3,(H2,25,29)