7-(3-azanylpropylamino)-5-[(4-morpholin-4-ylphenyl)amino]-1H-pyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 7-(3-azanylpropylamino)-5-[(4-morpholin-4-ylphenyl)amino]-1H-pyrido[4,3-d]pyrimidin-4-one Openeye Name: 7-(3-aminopropylamino)-5-(4-morpholinoanilino)-1H-pyrido[4,3-d]pyrimidin-4-one CAS Name: 7-(3-aminopropylamino)-5-[4-(4-morpholinyl)anilino]-1H-pyrido[4,3-d]pyrimidin-4-one IUPAC Name: 7-(3-aminopropylamino)-5-(4-morpholin-4-ylanilino)-1H-pyrido[4,3-d]pyrimidin-4-one Traditional Name: 7-(3-aminopropylamino)-5-(4-morpholinoanilino)-1H-pyrido[4,3-d]pyrimidin-4-one Formula: C20H25N7O2 MolecularWeight: 395.4582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=C4C(=CC(=N3)NCCCN)NC=NC4=O

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=C4C(=CC(=N3)NCCCN)NC=NC4=O

InChI

InChI=1S/C20H25N7O2/c21-6-1-7-22-17-12-16-18(20(28)24-13-23-16)19(26-17)25-14-2-4-15(5-3-14)27-8-10-29-11-9-27/h2-5,12-13H,1,6-11,21H2,(H2,22,25,26)(H,23,24,28)