6-butoxy-8-cyclopentyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 6-butoxy-8-cyclopentyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 6-butoxy-8-cyclopentyl-2-[(5-piperazin-1-yl-2-pyridyl)amino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 6-butoxy-8-cyclopentyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 6-butoxy-8-cyclopentyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one Traditional Name: 6-butoxy-8-cyclopentyl-2-[(5-piperazino-2-pyridyl)amino]pyrido[2,3-d]pyrimidin-7-one Formula: C25H33N7O2 MolecularWeight: 463.57522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CCNCC5

Isomeric SMILES

CCCCOC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C25H33N7O2/c1-2-3-14-34-21-15-18-16-28-25(30-23(18)32(24(21)33)19-6-4-5-7-19)29-22-9-8-20(17-27-22)31-12-10-26-11-13-31/h8-9,15-17,19,26H,2-7,10-14H2,1H3,(H,27,28,29,30)