10-methyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one

Systemtic Name: 10-methyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one Openeye Name: 10-methyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one CAS Name: 10-methyl-5-(octylamino)-2-phenyl-4-pyrimido[4,5-b]quinolinone IUPAC Name: 10-methyl-5-(octylamino)-2-phenylpyrimido[4,5-b]quinolin-4-one Traditional Name: 10-methyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one Formula: C26H30N4O MolecularWeight: 414.5426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C2C(=NC(=NC2=O)C3=CC=CC=C3)N(C4=CC=CC=C41)C

Isomeric SMILES

CCCCCCCCNC1=C2C(=NC(=NC2=O)C3=CC=CC=C3)N(C4=CC=CC=C41)C

InChI

InChI=1S/C26H30N4O/c1-3-4-5-6-7-13-18-27-23-20-16-11-12-17-21(20)30(2)25-22(23)26(31)29-24(28-25)19-14-9-8-10-15-19/h8-12,14-17,27H,3-7,13,18H2,1-2H3