2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)propanamide

Systemtic Name: 2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: 2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: 2-[[2-(2-furanyl)-4-quinazolinyl]thio]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: 2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: 2-[[2-(2-furyl)quinazolin-4-yl]thio]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O5S/c1-13(21(27)24-17-10-9-14(30-2)12-18(17)26(28)29)32-22-15-6-3-4-7-16(15)23-20(25-22)19-8-5-11-31-19/h3-13H,1-2H3,(H,24,27)