2-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[[7-chloro-3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[7-chloro-3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-(2-nitrophenyl)acetamide Formula: C23H17ClN4O4S MolecularWeight: 480.92348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H17ClN4O4S/c1-14-6-9-16(10-7-14)27-22(30)17-11-8-15(24)12-19(17)26-23(27)33-13-21(29)25-18-4-2-3-5-20(18)28(31)32/h2-12H,13H2,1H3,(H,25,29)