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

Systemtic Name: 8-cyclohexyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one hydrochloride Openeye Name: 8-cyclohexyl-2-[(5-piperazin-1-yl-2-pyridyl)amino]pyrido[2,3-d]pyrimidin-7-one hydrochloride CAS Name: 8-cyclohexyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]-7-pyrido[2,3-d]pyrimidinone hydrochloride IUPAC Name: 8-cyclohexyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one hydrochloride Traditional Name: 8-cyclohexyl-2-[(5-piperazino-2-pyridyl)amino]pyrido[2,3-d]pyrimidin-7-one hydrochloride Formula: C22H28ClN7O MolecularWeight: 441.95702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=NC=C(C=C4)N5CCNCC5.Cl

Isomeric SMILES

C1CCC(CC1)N2C(=O)C=CC3=CN=C(N=C32)NC4=NC=C(C=C4)N5CCNCC5.Cl

InChI

InChI=1S/C22H27N7O.ClH/c30-20-9-6-16-14-25-22(27-21(16)29(20)17-4-2-1-3-5-17)26-19-8-7-18(15-24-19)28-12-10-23-11-13-28;/h6-9,14-15,17,23H,1-5,10-13H2,(H,24,25,26,27);1H