2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[[2-(2-furanyl)-4-quinazolinyl]thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[[2-(2-furyl)quinazolin-4-yl]thio]-N-(3-nitrophenyl)propionamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C21H16N4O4S/c1-13(20(26)22-14-6-4-7-15(12-14)25(27)28)30-21-16-8-2-3-9-17(16)23-19(24-21)18-10-5-11-29-18/h2-13H,1H3,(H,22,26)