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

Systemtic Name: tert-butyl 4-[4-[(8-cyclopentyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(8-cyclopentyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(8-cyclopentyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(8-cyclopentyl-7-keto-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H34N6O3 MolecularWeight: 490.59726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)C5CCCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)N(C4=N3)C5CCCC5

InChI

InChI=1S/C27H34N6O3/c1-27(2,3)36-26(35)32-16-14-31(15-17-32)21-11-9-20(10-12-21)29-25-28-18-19-8-13-23(34)33(24(19)30-25)22-6-4-5-7-22/h8-13,18,22H,4-7,14-17H2,1-3H3,(H,28,29,30)