3-[2-oxidanylidene-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-[2-oxo-2-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-oxo-2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]ethyl]quinazolin-4-one Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)CN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H25N7O2/c30-21(14-29-16-25-18-6-2-1-5-17(18)22(29)31)28-11-9-27(10-12-28)20-13-19(23-15-24-20)26-7-3-4-8-26/h1-2,5-6,13,15-16H,3-4,7-12,14H2