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

Systemtic Name: 2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-[3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[[3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-[3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[[3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(3-nitrophenyl)propionamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S/c1-3-31-13-7-12-25-21(28)18-10-4-5-11-19(18)24-22(25)32-15(2)20(27)23-16-8-6-9-17(14-16)26(29)30/h4-6,8-11,14-15H,3,7,12-13H2,1-2H3,(H,23,27)