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

Systemtic Name: 4-azanyl-2-(2-methylpropoxy)-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one Openeye Name: 4-amino-2-isobutoxy-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one CAS Name: 4-amino-2-(2-methylpropoxy)-8-[[3-(1-pyrrolidinylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one IUPAC Name: 4-amino-2-(2-methylpropoxy)-8-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]-5,7-dihydropteridin-6-one Traditional Name: 4-amino-2-isobutoxy-8-[3-(pyrrolidinomethyl)benzyl]-5,7-dihydropteridin-6-one Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NC2=C(C(=N1)N)NC(=O)CN2CC3=CC(=CC=C3)CN4CCCC4

Isomeric SMILES

CC(C)COC1=NC2=C(C(=N1)N)NC(=O)CN2CC3=CC(=CC=C3)CN4CCCC4

InChI

InChI=1S/C22H30N6O2/c1-15(2)14-30-22-25-20(23)19-21(26-22)28(13-18(29)24-19)12-17-7-5-6-16(10-17)11-27-8-3-4-9-27/h5-7,10,15H,3-4,8-9,11-14H2,1-2H3,(H,24,29)(H2,23,25,26)