3-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]-4-pyrrolidino-benzamide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H23N5O3/c23-21(29)14-7-8-18(27-11-3-4-12-27)17(13-14)25-20(28)10-9-19-24-16-6-2-1-5-15(16)22(30)26-19/h1-2,5-8,13H,3-4,9-12H2,(H2,23,29)(H,25,28)(H,24,26,30)