3-(2-chlorophenyl)-2-[[[3-(pyrrolidin-1-ylmethyl)phenyl]amino]methyl]quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-[[[3-(pyrrolidin-1-ylmethyl)phenyl]amino]methyl]quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-[[3-(pyrrolidin-1-ylmethyl)anilino]methyl]quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-[[3-(1-pyrrolidinylmethyl)anilino]methyl]-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-[[3-(pyrrolidin-1-ylmethyl)anilino]methyl]quinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-[[3-(pyrrolidinomethyl)anilino]methyl]quinazolin-4-one Formula: C26H25ClN4O MolecularWeight: 444.9559

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)NCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)NCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl

InChI

InChI=1S/C26H25ClN4O/c27-22-11-2-4-13-24(22)31-25(29-23-12-3-1-10-21(23)26(31)32)17-28-20-9-7-8-19(16-20)18-30-14-5-6-15-30/h1-4,7-13,16,28H,5-6,14-15,17-18H2