N-(2-chloranyl-5-nitro-phenyl)-2-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[[4-keto-3-(m-tolyl)quinazolin-2-yl]thio]propionamide Formula: C24H19ClN4O4S MolecularWeight: 494.95006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H19ClN4O4S/c1-14-6-5-7-16(12-14)28-23(31)18-8-3-4-9-20(18)27-24(28)34-15(2)22(30)26-21-13-17(29(32)33)10-11-19(21)25/h3-13,15H,1-2H3,(H,26,30)