N-[2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-3-nitro-benzamide

Systemtic Name: N-[2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-3-nitro-benzamide Openeye Name: 3-nitro-N-[2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylacetyl]benzamide CAS Name: N-[2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-3-nitrobenzamide Traditional Name: N-[2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]acetyl]-3-nitro-benzamide Formula: C24H18N4O5S MolecularWeight: 474.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O5S/c1-15-9-11-17(12-10-15)27-23(31)19-7-2-3-8-20(19)25-24(27)34-14-21(29)26-22(30)16-5-4-6-18(13-16)28(32)33/h2-13H,14H2,1H3,(H,26,29,30)