tert-butyl 4-[4-[(6-bromanyl-8-cyclopentyl-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(6-bromanyl-8-cyclopentyl-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(6-bromo-8-cyclopentyl-4-methyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-1-carboxylate CAS Name: 4-[4-[(6-bromo-8-cyclopentyl-4-methyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]phenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(6-bromo-8-cyclopentyl-4-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-1-carboxylate Traditional Name: 4-[4-[(6-bromo-8-cyclopentyl-7-keto-4-methyl-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H36BrN5O3 MolecularWeight: 582.53184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)N(C2=NC(=N1)NC3=CC=C(C=C3)C4CCN(CC4)C(=O)OC(C)(C)C)C5CCCC5)Br

Isomeric SMILES

CC1=C2C=C(C(=O)N(C2=NC(=N1)NC3=CC=C(C=C3)C4CCN(CC4)C(=O)OC(C)(C)C)C5CCCC5)Br

InChI

InChI=1S/C29H36BrN5O3/c1-18-23-17-24(30)26(36)35(22-7-5-6-8-22)25(23)33-27(31-18)32-21-11-9-19(10-12-21)20-13-15-34(16-14-20)28(37)38-29(2,3)4/h9-12,17,20,22H,5-8,13-16H2,1-4H3,(H,31,32,33)