2-[azepan-4-yl(pyridin-2-yl)amino]-8-cyclopentyl-6-ethyl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 2-[azepan-4-yl(pyridin-2-yl)amino]-8-cyclopentyl-6-ethyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 2-[azepan-4-yl(2-pyridyl)amino]-8-cyclopentyl-6-ethyl-pyrido[2,3-d]pyrimidin-7-one CAS Name: 2-[4-azepanyl(2-pyridinyl)amino]-8-cyclopentyl-6-ethyl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-[azepan-4-yl(pyridin-2-yl)amino]-8-cyclopentyl-6-ethylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 2-[azepan-4-yl(2-pyridyl)amino]-8-cyclopentyl-6-ethyl-pyrido[2,3-d]pyrimidin-7-one Formula: C25H32N6O MolecularWeight: 432.56118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)N(C4CCCNCC4)C5=CC=CC=N5

Isomeric SMILES

CCC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)N(C4CCCNCC4)C5=CC=CC=N5

InChI

InChI=1S/C25H32N6O/c1-2-18-16-19-17-28-25(29-23(19)31(24(18)32)20-8-3-4-9-20)30(22-11-5-6-14-27-22)21-10-7-13-26-15-12-21/h5-6,11,14,16-17,20-21,26H,2-4,7-10,12-13,15H2,1H3