4-azanyl-5-(3-phenoxyphenyl)-2-piperidin-1-yl-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one

Systemtic Name: 4-azanyl-5-(3-phenoxyphenyl)-2-piperidin-1-yl-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-5-(3-phenoxyphenyl)-2-(1-piperidyl)-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-5-(3-phenoxyphenyl)-2-(1-piperidinyl)-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-5-(3-phenoxyphenyl)-2-piperidin-1-yl-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-5-(3-phenoxyphenyl)-2-piperidino-7,8,9,10-tetrahydro-5H-pyrimido[4,5-b]quinolin-6-one Formula: C28H29N5O2 MolecularWeight: 467.56216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=C(C(C4=C(N3)CCCC4=O)C5=CC(=CC=C5)OC6=CC=CC=C6)C(=N2)N

Isomeric SMILES

C1CCN(CC1)C2=NC3=C(C(C4=C(N3)CCCC4=O)C5=CC(=CC=C5)OC6=CC=CC=C6)C(=N2)N

InChI

InChI=1S/C28H29N5O2/c29-26-25-23(18-9-7-12-20(17-18)35-19-10-3-1-4-11-19)24-21(13-8-14-22(24)34)30-27(25)32-28(31-26)33-15-5-2-6-16-33/h1,3-4,7,9-12,17,23H,2,5-6,8,13-16H2,(H3,29,30,31,32)