4-azanyl-2-pyrrolidin-1-yl-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one

Systemtic Name: 4-azanyl-2-pyrrolidin-1-yl-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one Openeye Name: 4-amino-2-pyrrolidin-1-yl-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one CAS Name: 4-amino-2-(1-pyrrolidinyl)-8-[[3-(1-pyrrolidinylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one IUPAC Name: 4-amino-2-pyrrolidin-1-yl-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one Traditional Name: 4-amino-2-pyrrolidino-8-[3-(pyrrolidinomethyl)benzyl]-5,7-dihydropteridin-6-one Formula: C22H29N7O MolecularWeight: 407.51196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC(=C2)CN3CC(=O)NC4=C3N=C(N=C4N)N5CCCC5

Isomeric SMILES

C1CCN(C1)CC2=CC=CC(=C2)CN3CC(=O)NC4=C3N=C(N=C4N)N5CCCC5

InChI

InChI=1S/C22H29N7O/c23-20-19-21(26-22(25-20)28-10-3-4-11-28)29(15-18(30)24-19)14-17-7-5-6-16(12-17)13-27-8-1-2-9-27/h5-7,12H,1-4,8-11,13-15H2,(H,24,30)(H2,23,25,26)