N-(5-chloranyl-2-nitro-phenyl)-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-nitro-phenyl)-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-nitro-phenyl)-2-[3-(4-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-nitrophenyl)-2-[[4-oxo-3-(4-propan-2-ylphenyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(5-chloro-2-nitrophenyl)-2-[4-oxo-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-nitro-phenyl)-2-[(4-keto-3-p-cumenyl-quinazolin-2-yl)thio]acetamide Formula: C25H21ClN4O4S MolecularWeight: 508.97664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN4O4S/c1-15(2)16-7-10-18(11-8-16)29-24(32)19-5-3-4-6-20(19)28-25(29)35-14-23(31)27-21-13-17(26)9-12-22(21)30(33)34/h3-13,15H,14H2,1-2H3,(H,27,31)