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

Systemtic Name: 10-ethyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one Openeye Name: 10-ethyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one CAS Name: 10-ethyl-5-(octylamino)-2-phenyl-4-pyrimido[4,5-b]quinolinone IUPAC Name: 10-ethyl-5-(octylamino)-2-phenylpyrimido[4,5-b]quinolin-4-one Traditional Name: 10-ethyl-5-(octylamino)-2-phenyl-pyrimido[4,5-b]quinolin-4-one Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O/c1-3-5-6-7-8-14-19-28-24-21-17-12-13-18-22(21)31(4-2)26-23(24)27(32)30-25(29-26)20-15-10-9-11-16-20/h9-13,15-18,28H,3-8,14,19H2,1-2H3