N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-morpholinopropyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-4-oxo-3-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-[3-(2-ketopyrrolidino)propyl]-N-(3-morpholinopropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H31N5O4S MolecularWeight: 473.58834

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2C(=O)C3=C(C=C(C=C3)C(=O)NCCCN4CCOCC4)NC2=S

Isomeric SMILES

C1CC(=O)N(C1)CCCN2C(=O)C3=C(C=C(C=C3)C(=O)NCCCN4CCOCC4)NC2=S

InChI

InChI=1S/C23H31N5O4S/c29-20-4-1-9-27(20)10-3-11-28-22(31)18-6-5-17(16-19(18)25-23(28)33)21(30)24-7-2-8-26-12-14-32-15-13-26/h5-6,16H,1-4,7-15H2,(H,24,30)(H,25,33)