N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)CNC(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)CNC(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C25H28N4O3S/c30-22(26-17-18-8-6-9-19(16-18)28-15-7-13-23(28)31)12-2-1-5-14-29-24(32)20-10-3-4-11-21(20)27-25(29)33/h3-4,6,8-11,16H,1-2,5,7,12-15,17H2,(H,26,30)(H,27,33)