tert-butyl 4-[6-[(8-cyclohexyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[(8-cyclohexyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[6-[(8-cyclohexyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridyl]piperazine-1-carboxylate CAS Name: 4-[6-[(8-cyclohexyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]-3-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[(8-cyclohexyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[6-[(8-cyclohexyl-7-keto-pyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H35N7O3 MolecularWeight: 505.6119

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CN=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)C5CCCCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CN=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)C5CCCCC5

InChI

InChI=1S/C27H35N7O3/c1-27(2,3)37-26(36)33-15-13-32(14-16-33)21-10-11-22(28-18-21)30-25-29-17-19-9-12-23(35)34(24(19)31-25)20-7-5-4-6-8-20/h9-12,17-18,20H,4-8,13-16H2,1-3H3,(H,28,29,30,31)